Observable-conditioned ΔC distributions (v30.10)

Rui Huang

Joel N. Bregman

Abstract
X 射线灵敏度计算常用一个期望值代替 Cash 统计量的似然比改进量 ΔC\Delta C。在探测阈值附近,还需要它的条件宽度。我们推导了显式的像素求和表达式。它们给出三参数点扩散函数(PSF)拟合中 ΔC\Delta C 的主导期望数据位置和投影方差。该均值扩展了已有的解析灵敏度计算。投影方差是我们的主要解析结果。在低信号下,我们采用以可观测量为条件的核。这里,Ŝ\widehat S 是拟合幅度,bb 是局部背景。符号 𝒫\mathcal{P}\mathcal{M} 分别是像素化 PSF 和拟合掩膜。索引 kk 表示拟合器和仪器。μ3p\mu_{3p}V3pV_{3p} 是解析位置和方差。FkF_kGkG_k 分别修正低信号下的均值和标准差。参考拟合器样本包含 810,987 次干净的 XMM-Newton PN 第 4 波段(2.0–4.5 keV)实现。其中 266,837 次高信号拟合的标准化残差均值为 0.068±0.0020.068\pm 0.002,宽度为 0.977±0.0010.977\pm 0.001。我们用分别拟合的 μ3p\mu_{3p} 紧凑函数描述低信号下均值和标准差的变化。我们在留出数据上检验 DET_ML=6\mathrm{DET\_ML}=6、8 和 10 时的通过率。原始 Fisher 理论的平均误差为 0.01359±0.000100.01359\pm 0.00010。同时加入两项修正后,该误差为 0.00199±0.000080.00199\pm 0.00008。经验分箱基准为 0.00196±0.000080.00196\pm 0.00008。整位置验证表明,只修正均值不能确定宽度修正。一项有针对性的配对模拟发现,质心重定位和位置最大化对低信号偏移的正贡献最大。该结果适用于整数网格参考拟合器。在阈值带内,检验的六个百分位都在 0.7 个百分点内一致。第 2.3 和第 10 百分位在 0.5 个百分点内一致。该标定支持拟合幅度图。独立运行的 emldetect 案例说明了如何用稀疏且依赖位置的均值标定补充解析公式。独立运行的 M1/M2 emldetect 模拟还表明,PN 参考拟合器系数不能直接转移。位置与宽度结构可以复用,但其系数取决于配置。该核支持拟合幅度阈值穿越图和目录空间选择概率。两种用途都仍在拟合幅度坐标中。

X-ray sensitivity calculations often replace the Cash-statistic likelihood-ratio improvement, ΔC\Delta C, with one expected value. Near a detection threshold, its conditional width is also needed. We derive explicit pixel-sum expressions for the leading expected-data location and projected variance of ΔC\Delta C from a three-parameter point-spread-function (PSF) fit. The mean extends earlier analytic sensitivity calculations. The projected variance is our main analytic result. At low signal, we use the observable-conditioned kernel

ΔCŜ,b,𝒫,,k𝒩[μ3p+V3pFk,V3pGk2].\displaystyle \Delta C\mid\widehat S,b,\mathcal{P},\mathcal{M},k\simeq \mathcal{N}[\mu_{3p}+\sqrt{V_{3p}}F_k,V_{3p}G_k^2].

Here Ŝ\widehat S is fitted amplitude, and bb is local background. The symbols 𝒫\mathcal{P} and \mathcal{M} are the pixelized PSF and fitting mask. The index kk labels the fitter and instrument. The terms μ3p\mu_{3p} and V3pV_{3p} are the analytic location and variance. The functions FkF_k and GkG_k correct their low-signal mean and standard deviation. The reference-fitter sample contains 810,987 clean XMM-Newton PN band 4 (2.0--4.5 keV) realizations. Its 266,837 high-signal fits have a standardized-residual mean of 0.068±0.0020.068\pm0.002 and width of 0.977±0.0010.977\pm0.001. Compact, separately fitted functions of μ3p\mu_{3p} describe the low-signal changes in mean and standard deviation. We test the passing fractions on held-out data at DET_ML=6\mathrm{DET\_ML}=6, 8, and 10. The mean error is 0.01359±0.000100.01359\pm0.00010 for raw Fisher theory and 0.00199±0.000080.00199\pm0.00008 after both corrections. The empirical-bin benchmark is 0.00196±0.000080.00196\pm0.00008. Whole-position validation shows that the mean correction alone cannot determine the width correction. A targeted paired simulation finds that centroid relocation and position maximization give the largest positive contribution to the low-signal shift. This result applies to the integer-grid reference fitter. In the threshold band, all six tested percentiles agree within 0.7 percentage points. The 2.3th and 10th percentiles agree within 0.5 percentage points. This calibration supports the fitted-amplitude maps. A standalone emldetect case study shows how the analytic formula can be supplemented by a sparse position-dependent mean calibration. Standalone M1/M2 emldetect simulations also show that the PN reference-fitter coefficients do not transfer directly. The location–scale structure is reusable, but its coefficients are configuration specific. The kernel supports fitted-amplitude threshold-crossing maps and catalog-space selection probabilities. Both uses remain in the fitted-amplitude coordinate.

Introduction

泊松计数源探测在已知背景之上拟合源模型。泊松模型描述围绕期望数目随机变化的计数。似然比比较两个模型对同一数据的解释程度。在标准 Cash 统计量形式中 (Cash 1979),改进量为 ΔC=CnullCbest\Delta C = C_\mathrm{null} - C_\mathrm{best}。除一个常数外,CC 等于泊松对数似然负值的两倍。探测流水线常将 ΔC\Delta C 的单调变换报告为“探测似然”。这里的单调是指该变换保持 ΔC\Delta C 数值的次序。在 XMM-Newton 科学分析系统中,emldetect 拟合一个幅度和两个位置坐标 (Cruddace et al. 1988; Watson et al. 2009)。它报告 DET_ML\mathrm{DET\_ML},即 ΔC\Delta C 的不完全伽马变换。该统计量用于目录条目、探测阈值和灵敏度图。

Poisson-count source detection fits a source model above a known background. A Poisson model describes random counts around an expected number. A likelihood ratio compares how well two models explain the same data. In the standard Cash-statistic formulation (Cash 1979), the improvement is ΔC=CnullCbest\Delta C = C_\mathrm{null} - C_\mathrm{best}. Apart from a constant, CC equals twice the negative Poisson log-likelihood. Detection pipelines often report a monotone transform of ΔC\Delta C as a “detection likelihood.” Here monotone means that the transform preserves the order of ΔC\Delta C values. In the XMM-Newton Science Analysis System, emldetect fits one amplitude and two position coordinates (Cruddace et al. 1988; Watson et al. 2009). It reports DET_ML\mathrm{DET\_ML}, an incomplete-gamma transform of ΔC\Delta C. This statistic is used for catalog entries, detection thresholds, and sensitivity maps.

主要的 X 射线巡天使用灵敏度图和源计数方法 (Cappelluti et al. 2009; Georgakakis et al. 2008; Laird et al. 2009; Luo et al. 2017, e.g.,; Mateos et al. 2008; Puccetti et al. 2009; Wang et al. 2016; Xue et al. 2011)。泊松源探测和似然比极限在高能天体物理中已有很长的研究历史 (Broos et al. 2010, e.g.,; Gehrels 1986; Kashyap et al. 2010; Kraft et al. 1991; Protassov et al. 2002; Starck et al. 2002)。XMM-Newton 源目录使用 emldetect (Carrera et al. 2007; Rosen et al. 2016; Traulsen et al. 2019; Watson et al. 2009; Webb et al. 2020)

Major X-ray surveys use sensitivity maps and source-count methods (Cappelluti et al. 2009; Georgakakis et al. 2008; Laird et al. 2009; Luo et al. 2017, e.g.,; Mateos et al. 2008; Puccetti et al. 2009; Wang et al. 2016; Xue et al. 2011). Poisson source detection and likelihood-ratio limits have a long history in high-energy astrophysics (Broos et al. 2010, e.g.,; Gehrels 1986; Kashyap et al. 2010; Kraft et al. 1991; Protassov et al. 2002; Starck et al. 2002). XMM-Newton source catalogs use emldetect (Carrera et al. 2007; Rosen et al. 2016; Traulsen et al. 2019; Watson et al. 2009; Webb et al. 2020).

我们只把 DET_ML\mathrm{DET\_ML} 用作 SAS 定义的有序阈值标度。我们不把它视为经过校准的频率学派虚警概率。通常的 χ32\chi^2_3 零假设参考分布要求模型参数具有正则性,并且远离边界。这里不满足该假设。源幅度位于边界上,而源位置在零假设下没有定义 (Chernoff 1954; Protassov et al. 2002; Self & Liang 1987)Stewart (2009) 用蒙特卡洛实验检验了相应的 Cash 统计量参考分布。排除负幅度解后,该参考分布对有代表性的搜索有用。低计数 Cash 统计量也可能不同于其高计数极限 (Bonamente 2020)。我们不尝试解决这个零假设标定问题。我们只出于一个目的使用 DET_ML\mathrm{DET\_ML}ΔC\Delta C 之间的转换。它把选定的流水线阈值转换为下文建模的统计量。

We use DET_ML\mathrm{DET\_ML} only as the ordered threshold scale defined by SAS. We do not treat it as a calibrated frequentist false-alarm probability. The usual χ32\chi^2_3 null reference assumes regular model parameters away from boundaries. This assumption fails here. Source amplitude lies on a boundary, and source position is undefined under the null (Chernoff 1954; Protassov et al. 2002; Self & Liang 1987). Monte Carlo experiments by Stewart (2009) tested the corresponding Cash-statistic reference. It was useful for representative searches after negative-amplitude solutions were excluded. The low-count Cash statistic can also differ from its high-count limit (Bonamente 2020). We do not try to settle this null-calibration question. We use the conversion between DET_ML\mathrm{DET\_ML} and ΔC\Delta C for one purpose. It translates a chosen pipeline threshold into the statistic modeled below.

实际使用的阈值范围处于低信号区。许多 XMM-Newton 应用采用约 6–10 的 DET_ML\mathrm{DET\_ML} 来制作灵敏度图。这个范围内的源计数分布很陡,泊松波动很重要。因此,较小的阈值偏移也可能改变推断出的极限流量。Eddington 偏差也很重要。在探测边界附近,向上的波动更容易被选中。因此,选中样本不同于完整的母体分布 (Eddington 1913; Wang 2004)

The practical threshold range has low signal. For many XMM-Newton applications, sensitivity maps use DET_ML\mathrm{DET\_ML} of order 6–10. Source counts are steep in this range, and Poisson fluctuations matter. A small threshold shift can therefore change the inferred limiting flux. Eddington bias also matters. Near the detection boundary, upward fluctuations are selected more often. The selected sample then differs from the full parent distribution (Eddington 1913; Wang 2004).

相关形式的解析均值已经存在。Stewart (2009) 为灵敏度计算推导了只拟合幅度时的 Cash 统计量期望。该工作扩展了更早的匹配滤波研究 (Stewart 2006)。SAS esensmap 也在 3XMM 和 4XMM 流水线中采用了 emldetect 形式的解析 Cash 模型 (Rosen et al. 2016; Traulsen et al. 2019)。New-ANGELS XMM 巡天在拟合流量而不是注入流量处计算了相关期望 (Huang et al. 2025, appendix)。谱拟合优度问题中也存在 Cash 统计量的矩 (Kaastra 2017)。这些矩描述的量不同于本文研究的源模型相对背景模型的改进量。

The analytical mean is already known in related forms. Stewart (2009) derived an amplitude-only Cash-statistic expectation for sensitivity calculations. That work extended an earlier matched-filter study (Stewart 2006). SAS esensmap also uses an emldetect-style analytic Cash model in the 3XMM and 4XMM pipelines (Rosen et al. 2016; Traulsen et al. 2019). The New-ANGELS XMM survey evaluated a related expectation at fitted flux instead of injected flux (Huang et al. 2025, appendix). Cash-statistic moments also exist for spectral goodness-of-fit problems (Kaastra 2017). Those moments describe a different quantity from the source-versus-background improvement studied here.

尚未解决的量是探测改进量的条件宽度。我们没有找到在拟合幅度和两个位置坐标后,针对 ΔC\Delta C 给出的更早的显式像素求和方差。我们也没有找到把这一宽度向前传递的拟合可观测量阈值计算。因此,我们把问题分成解析的位置项和宽度项,再加上低计数经验修正。Asimov 项是期望数据上的似然差,并给出位置。相关的 Kullback–Leibler 量衡量期望对数似然差。Fisher/Wald 投影给出主导方差 (Cowan et al. 2011; Wilks 1938)。Fisher 投影去除被拟合参数吸收的波动方向。我们的结果是联合测光与天体测量相关 Fisher 分析在像素化泊松成像中的形式 (Mendez et al. 2014)

The unresolved quantity is the conditional width of the detection improvement. We find no earlier explicit pixel-sum variance for ΔC\Delta C after fitting amplitude and two position coordinates. We also find no fitted-observable threshold calculation that carries this width forward. We therefore separate the problem into analytic location and scale terms plus an empirical low-count correction. The Asimov term is the expected-data likelihood contrast and gives the location. The related Kullback–Leibler quantity measures the expected log-likelihood difference. A Fisher/Wald projection gives the leading variance (Cowan et al. 2011; Wilks 1938). Fisher projection removes fluctuation directions absorbed by fitted parameters. Our result is the pixelized Poisson-imaging version of related Fisher analyses of joint photometry and astrometry (Mendez et al. 2014).

投影恒等式是标准结果。我们的新步骤是给出它在自由位置泊松 PSF 拟合中的显式像素求和形式。我们还在探测阈值附近验证了它。V3pV_{3p} 是预测的三参数方差。它只使用拟合幅度、背景、PSF 和掩膜。它不含拟合系数。经验函数 FkF_kGkG_k 给出较小的低计数修正。它们不取代解析公式。

The projection identity is standard. Our new step is its explicit pixel-sum form for a free-position Poisson PSF fit. We also validate it near the detection threshold. The quantity V3pV_{3p} is the predicted three-parameter variance. It uses only the fitted amplitude, background, PSF, and mask. It has no fitted coefficient. The empirical functions FkF_k and GkG_k give small low-count corrections. They do not replace the analytic formula.

得到的模型具有共同结构,但没有一组通用的经验系数。第 2 节定义式([eq:master-kernel])中的所有符号。函数 FkF_kGkG_k 必须分别估计。正确的均值会在测量宽度前去除分箱内的梯度。它并不能设定宽度。我们只在构造这个分布后,才应用从 ΔC\Delta CDET_ML\mathrm{DET\_ML} 的非线性不完全伽马变换。

The resulting model has a common structure but not a universal set of empirical coefficients: ΔCŜ,b,𝒫,,k𝒩[μ3p+V3pFk(μ3p),V3pGk2(μ3p)].\Delta C\mid\widehat S,b,\mathcal{P},\mathcal{M},k \simeq \mathcal{N}\!\left[ \mu_{3p}+\sqrt{V_{3p}}F_k(\mu_{3p}), V_{3p}G_k^2(\mu_{3p}) \right]. \label{eq:master-kernel} Section 2 defines all symbols in Equation ([eq:master-kernel]). The functions FkF_k and GkG_k must be estimated separately. A correct mean removes gradients within a bin before the width is measured. It does not set the width. We apply the nonlinear incomplete-gamma transform from ΔC\Delta C to DET_ML\mathrm{DET\_ML} only after constructing this distribution.

第 2 节给出条件化和选择规则。第 3 节推导解析位置和 Fisher 投影方差。第 4 节验证参考拟合器核及其两个独立的低计数修正。第 5 节给出独立运行的 emldetect 的流水线专属标定案例。该节还检验配置之间的转移。第 6 节给出拟合幅度阈值穿越和目录用途。第 7 和第 8 节给出适用范围限制和结论。

Section 2 gives the conditioning and selection rules. Section 3 derives the analytic location and Fisher-projected variance. Section 4 validates the reference-fitter kernel and its separate low-count corrections. Section 5 presents a pipeline-specific calibration case study with standalone emldetect. It also tests transfer across configurations. Section 6 gives fitted-amplitude threshold crossings and catalog uses. Sections 7 and 8 give the scope limits and conclusions.

Observable-Conditioned Residuals

核心量是 ΔC\Delta C,即以拟合数据为条件的 Cash 统计量改进量:

The central quantity is ΔC\Delta C, the Cash-statistic improvement, conditioned on fitted data:

p(ΔCŜ,b,𝒫,,k).p(\Delta C\mid \widehat{S},b,\mathcal{P},\mathcal{M},k).

这里的条件化是指固定所列出的拟合量。符号 Ŝ\widehat{S} 是拟合幅度。符号 bb 是每像素计数表示的局部背景。符号 𝒫\mathcal{P} 是像素化 PSF,\mathcal{M} 是拟合掩膜。索引 kk 记录拟合器和仪器配置。μ3p\mu_{3p}V3pV_{3p} 是解析的三参数位置和方差。函数 FkF_kGkG_k 修正低计数下的位置和宽度。

Here conditioning means holding the listed fitted quantities fixed. The symbol Ŝ\widehat{S} is the fitted source amplitude. The symbol bb is the local background in counts per pixel. The symbol 𝒫\mathcal{P} is the pixelized PSF, and \mathcal{M} is the fitting mask. The index kk records the fitter and instrumental configuration. The terms μ3p\mu_{3p} and V3pV_{3p} are the analytic three-parameter location and variance. The functions FkF_k and GkG_k correct the low-count location and width.

Conditioning on fitted amplitude

在模拟中,StrueS_\mathrm{true} 表示注入幅度。对于单独的生成模型 p(Ŝ,ΔCStrue)p(\widehat S,\Delta C\mid S_\mathrm{true}),它是正确的变量。然而,目录源没有可观测的 StrueS_\mathrm{true}。因此,它不是我们的拟合可观测量核中的条件变量。我们只用 StrueS_\mathrm{true} 做生成过程检查。所有 ΔC\Delta C 的矩估计都以 Ŝ\widehat S 为条件。以 StrueS_\mathrm{true} 为条件可以检验已知注入流量下的行为。以 Ŝ\widehat S 为条件可以检验拟合源之后的核。我们的核和拟合幅度穿越图只使用后一种情况。

In simulations, StrueS_\mathrm{true} labels the injected source amplitude. It is the right variable for the separate generation model p(Ŝ,ΔCStrue)p(\widehat S,\Delta C\mid S_\mathrm{true}). However, catalog sources do not have an observed StrueS_\mathrm{true}. It is therefore not the conditioning variable in our fitted-observable kernel. We use StrueS_\mathrm{true} only for generation checks. All ΔC\Delta C moment estimates are conditioned on Ŝ\widehat S. Conditioning on StrueS_\mathrm{true} tests behavior at a known injected flux. Conditioning on Ŝ\widehat S tests the kernel after fitting a source. Only the second case is used for our kernel and fitted-amplitude crossing maps.

Separating the mean and residual

对于每个源或假源试验,我们在观测到的拟合量处计算理论:

For each source or fake-source trial, we evaluate the theory at the observed fitted quantities:

μ3p,iμAsimov(Ŝi,bi,psfi,maski)E[ΔCŜi,bi,psfi,maski]\mu_{3p,i} \equiv \mu_\mathrm{Asimov}(\widehat S_i,b_i,\mathrm{psf}_i,\mathrm{mask}_i) \simeq E[\Delta C\mid\widehat S_i,b_i,\mathrm{psf}_i,\mathrm{mask}_i]

残差为

and the residual is

Ri=ΔCiμ3p,i.R_{i} = \Delta C_{i} - \mu_{3p,i}.

对于一个样本或分箱,

For a sample or bin,

ΔC=R+μ3p,Var(ΔC)=Var(R)+Var(μ3p)+2Cov(R,μ3p)\begin{aligned} \langle \Delta C \rangle &= \langle R \rangle + \langle \mu_{3p} \rangle, \\ \mathrm{Var}(\Delta C) &= \mathrm{Var}(R) + \mathrm{Var}(\mu_{3p}) + 2\,\mathrm{Cov}(R, \mu_{3p}) \end{aligned}

符号 μ3p\mu_{3p} 是三参数拟合的预测均值。观测到的 ΔC\Delta C 方差只有在以下条件下才等于 Var(R)\mathrm{Var}(R)μ3p\mu_{3p} 在分箱内近似为常数。否则,混合不同的拟合幅度或位置会在条件理论之外增加方差。因此,我们在用于估计宽度的单元中估计局部条件均值。计算标准差之前,我们减去这一局部趋势。这个步骤需要均值,但剩余宽度是一个独立目标。按 StrueS_\mathrm{true} 分箱会混合不同的拟合幅度,还可能增大表观的位置依赖。按观测到的 DET_ML\mathrm{DET\_ML}ΔC\Delta C 或残差进行截断还有另一个问题。这样会删除正被测量矩的分布的一部分。下文不采用这两种操作。

The symbol μ3p\mu_{3p} is the predicted mean for a three-parameter fit. The observed ΔC\Delta C variance equals Var(R)\mathrm{Var}(R) only when μ3p\mu_{3p} is nearly constant across the bin. Otherwise, mixing fitted amplitudes or positions adds variance outside the conditional theory. We therefore estimate a local conditional mean in the cells used for the width. We subtract this local trend before computing the standard deviation. The mean is needed for this step, but the remaining width is a separate target. Binning by StrueS_\mathrm{true} mixes fitted amplitudes and can increase the apparent position dependence. A cut on observed DET_ML\mathrm{DET\_ML}, ΔC\Delta C, or the residual has a second problem. It removes part of the distribution whose moments are being measured. We use neither operation below.

Threshold selection in ΔC\Delta C space

统计量 DET_ML\mathrm{DET\_ML}ΔC\Delta C 的非线性且保持次序的尾概率变换:

The statistic DET_ML\mathrm{DET\_ML} is a nonlinear, order-preserving tail-probability transform of ΔC\Delta C:

DET_ML=lnQ(ν/2,ΔC/2),\mathrm{DET\_ML}= -\ln Q(\nu/2, \Delta C/2),

这里 ν=3\nu=3。对于单源三参数拟合,不完全伽马函数的形状参数为 ν/2=1.5\nu/2=1.5。相应的逆变换如下。这里,ΔCth\Delta C_{\mathrm{th}} 是 Cash 改进量空间中的阈值。函数 QQ 是正则化上不完全伽马函数。它给出伽马分布的上尾概率。记号 Qx1Q_x^{-1} 表示对它的第二个变量求逆。因此,DET_ML=6,8,10\mathrm{DET\_ML}=6,\,8,\,10 分别对应 ΔCth=14.3,18.6,22.8\Delta C_{\mathrm{th}}=14.3,\,18.6,\,22.8。所以,ΔC\Delta C 中的高斯残差经过变换后在 DET_ML\mathrm{DET\_ML} 中并不是高斯分布。按观测到的 DET_ML\mathrm{DET\_ML} 选择也等于按正被测量的带噪声量选择。这样会删除残差分布的下部,并抬高阈值附近的均值。我们改用三参数约定把阈值范围转换为 ΔC\Delta C。然后,我们使用 $\mu_{3p,\rm ref}\in[\Delta C_\mathrm{ML6},\Delta C_\mathrm{ML10}]$ 等预测条件。等价的做法是使用 Ŝ\widehat{S} 分箱,这些分箱的典型预测 ΔC\Delta C 位于该区间。这样,条件化仍独立于 ΔCeml\Delta C_\mathrm{eml} 中观测到的随机波动。

with ν=3\nu=3. The incomplete gamma function then has shape parameter ν/2=1.5\nu/2=1.5 for a single-source three-parameter fit. The corresponding inverse is ΔCth=2Qx1(1.5,exp(DET_ML)),\Delta C_{\mathrm{th}} = 2\,Q_x^{-1}(1.5, \exp(-\mathrm{DET\_ML})), \label{eq:detml-inverse} Here ΔCth\Delta C_{\mathrm{th}} is the threshold in Cash-improvement space. The function QQ is the regularized upper incomplete gamma function. It gives the upper-tail probability of a gamma distribution. The notation Qx1Q_x^{-1} means inversion in its second argument. Thus DET_ML=6,8,10\mathrm{DET\_ML}=6,\,8,\,10 correspond to ΔCth=14.3,18.6,22.8\Delta C_{\mathrm{th}}=14.3,\,18.6,\,22.8, respectively. A Gaussian residual in ΔC\Delta C is therefore not Gaussian after transformation to DET_ML\mathrm{DET\_ML}. Selecting on observed DET_ML\mathrm{DET\_ML} also selects the noisy quantity being measured. This removes the lower part of the residual distribution and raises its mean near the threshold. We instead convert threshold ranges to ΔC\Delta C with the three-parameter convention. We then use predicted conditions such as $\mu_{3p,\rm ref}\in[\Delta C_\mathrm{ML6},\Delta C_\mathrm{ML10}]$. An equivalent choice uses Ŝ\widehat{S} bins whose typical predicted ΔC\Delta C lies in that interval. The conditioning then remains independent of the observed random fluctuation in ΔCeml\Delta C_\mathrm{eml}.

Analytic Conditional Location and Fisher-Projected Variance

模型有一个自由幅度和两个自由位置坐标。Kullback–Leibler/Asimov 构造和 Fisher/Wald 投影恒等式是标准似然工具 (Cowan et al. 2011; Wilks 1938)。Asimov 构造在期望数据上计算统计量。Fisher/Wald 投影去除被拟合参数吸收的噪声方向。我们的新结果是给出它们在自由位置泊松 PSF 拟合中的显式像素求和形式。我们还验证了这一形式。投影方差是主要理论贡献,而不只是解析均值。

The model has one free amplitude and two free position coordinates. The Kullback–Leibler/Asimov construction and the Fisher/Wald projection identity are standard likelihood tools (Cowan et al. 2011; Wilks 1938). The Asimov construction evaluates a statistic on the expected data. The Fisher/Wald projection removes noise directions absorbed by fitted parameters. Our new result is their explicit pixel-sum form for a free-position Poisson PSF fit. We also validate this form. The projected variance, not the analytical mean alone, is the main theoretical contribution.

Pixelized Poisson model

考虑一个拟合区域,其中像素的索引为 ii。观测计数是相互独立的泊松随机变量:

Consider a fitting region with pixels indexed by ii. The observed counts are independent Poisson random variables:

YiPoisson(μi)Y_{i} \sim \mathrm{Poisson}(\mu_i)

对于局部背景已知的一个源,拟合模型为

For one source on a locally known background, the fitted model is

μi(θ)=bi+Spi(x,y),θ=(S,x,y)\begin{aligned} \mu_i(\theta) &= b_{i} + S\, p_{i}(x, y), \\ \theta &= (S, x, y) \end{aligned}

这里,bib_i 是像素 ii 中的期望背景。符号 SS 是图像模型单位中的源幅度。函数 pi(x,y)p_i(x,y) 是平移到位置 (x,y)(x,y) 的像素化 PSF 模板。我们用 𝒫\mathcal{P} 表示这个像素化 PSF。PSF 在完整模板网格上归一化,即 ipi=1\sum_i p_i=1。掩膜值 MiM_i 随后选择拟合区域,我们用 \mathcal{M} 表示该区域。因此,SS 是模板约定下的总源幅度。它不是拟合掩膜内的源计数。在 PN 第 4 波段(2.0–4.5 keV)验证运行中,bib_i 在拟合区域内通常是常数 bb。该记号也允许背景随像素变化。

Here bib_i is the expected background in pixel ii. The symbol SS is the source amplitude in the image-model units. The function pi(x,y)p_i(x,y) is the pixelized PSF template shifted to position (x,y)(x,y). We denote this pixelized PSF by 𝒫\mathcal{P}. The PSF is normalized over the full template grid, ipi=1\sum_i p_i=1. The mask value MiM_i then selects the fitting footprint, denoted by \mathcal{M}. Thus SS is the total source amplitude in the template convention. It is not the source count inside the fitting mask. In the PN band 4 (2.0--4.5 keV) validation runs, bib_i is usually a constant bb within the fitting region. The notation also allows a background that varies by pixel.

二元拟合掩膜 MiM_i 选择参与拟合的像素。主要结果使用这些二元掩膜。加权扩展允许分数权重。当权重严格等于 0 或 1 时,它就退化为本文使用的二元约定。

A binary fitting mask MiM_i selects the pixels in the fit. The main results use these binary masks. A weighted extension allows fractional weights. When the weights are exactly 0 or 1, it reduces to the binary convention used here.

Cash statistic and ΔC\Delta C sign convention

去掉不依赖模型参数的常数后,Cash 统计量为

After dropping constants that do not depend on the model parameters, the Cash statistic is

C(θ)=2iMi[μi(θ)Yilnμi(θ)]C(\theta) = 2 \sum_i M_{i} \bigl[\mu_i(\theta) - Y_{i} \ln \mu_i(\theta)\bigr]

零模型只包含背景,即 μi,0=bi\mu_{i,0} = b_{i}。似然比 Cash 改进量为

The null model contains only the background, μi,0=bi\mu_{i,0} = b_{i}. The likelihood-ratio Cash improvement is

ΔC=CnullCbest\Delta C = C_{\mathrm{null}} - C_{\mathrm{best}}

按照这一符号约定,源拟合更好时 ΔC\Delta C 为正。在固定拟合模型 μi\mu_i 处,该统计量变为

With this sign convention, a better source fit gives positive ΔC\Delta C. At a fixed fitted model μi\mu_i, the statistic becomes

ΔC=2iMi[biμi+Yilog(μi/bi)]\Delta C = 2 \sum_i M_{i} \bigl[ b_{i} - \mu_i + Y_{i} \log(\mu_i / b_{i}) \bigr]

Asimov location at a fixed fitted result

以可观测量为条件的理论在下列位置计算其矩:

The observable-conditioned theory evaluates its moments at

θ̂=(Ŝ,x̂,ŷ),μi=bi+Ŝpi(x̂,ŷ)\begin{aligned} \widehat{\theta} &= (\widehat{S}, \widehat{x}, \widehat{y}), \\ \mu_i &= b_{i} + \widehat{S}\, p_{i}(\widehat{x},\widehat{y}) \end{aligned}

这里,Ŝ\widehat{S} 是拟合幅度。坐标 x̂\widehat{x}ŷ\widehat{y} 是它在图像中的拟合位置。

Here Ŝ\widehat{S} is the fitted source amplitude. The coordinates x̂\widehat{x} and ŷ\widehat{y} are its fitted image position.

Asimov 图像 (the expected dataset where observed counts equal the model expectation; Cowan et al. 2011) 对该拟合模型采用 Yi=μiY_i=\mu_i。把它代入 Cash 改进量,就得到主导条件位置。

The Asimov image (the expected dataset where observed counts equal the model expectation; Cowan et al. 2011) uses Yi=μiY_i=\mu_i for this fitted model. Substitution into the Cash improvement gives the leading conditional location:

μ3p(Ŝ,b,psf,mask)=2iMi[μiln(μibi)(μibi)]\mu_{3p}(\widehat{S},b,\mathrm{psf},\mathrm{mask}) = 2\sum_i M_i\left[\mu_i\ln\left(\frac{\mu_i}{b_i}\right)-(\mu_i-b_i)\right] \label{eq:mu3p}

对于常数背景 bi=bb_i = b 和归一化 PSF pip_i,可得下面的显式像素求和。

For a constant background bi=bb_i = b and normalized PSF pip_i, this gives the explicit pixel sum: μ3p=2iMi[(b+Ŝpi)log((b+Ŝpi)/b)Ŝpi]\mu_{3p} = 2 \sum_i M_{i} \bigl[ (b + \widehat{S}\, p_{i}) \log\bigl((b + \widehat{S}\, p_{i})/b\bigr) - \widehat{S}\, p_{i} \bigr] \label{eq:mu3p-pixel-sum}

符号 μ3p\mu_{3p} 是三参数拟合的预测位置。这个均值取决于对 PSF 和掩膜的完整像素求和。高斯宽度或少数低阶 PSF 矩不能确定它。不过,这些概括量仍可用于检查。

The symbol μ3p\mu_{3p} is the predicted location for a three-parameter fit. This mean depends on the full pixel sum over the PSF and mask. A Gaussian width or a few low-order PSF moments cannot determine it. However, those summaries can still be useful checks.

如果位置固定而只拟合幅度,式([eq:mu3p]) 就退化为 Stewart (2009) 使用的期望。本文的记号和对小经验偏移的处理有所不同。我们的扩展增加了三个方面。它以报告的拟合幅度为条件,包含拟合掩膜,并把两个拟合位置方向都纳入方差。

If position is fixed and only amplitude is fitted, Equation ([eq:mu3p]) reduces to the expectation used by Stewart (2009). The notation and treatment of a small empirical offset differ. Our extension adds three features. It conditions on the reported fitted amplitude, includes the fitting mask, and carries both fitted position directions into the variance.

ri=μi/bir_i = \mu_i / b_i,式 [eq:mu3p] 可写为 μ3p=2iMibi[rilnri(ri1)]\mu_{3p} = 2\sum_i M_i b_i [r_i \ln r_i - (r_i - 1)]。这是逐像素泊松 Kullback–Leibler 散度的两倍,再对拟合区域求和。它是局部似然比近似中的 Asimov 位置 (Cowan et al. 2011)。这并不表示有限计数、自由位置的分布严格服从非中心 χ32\chi^2_3。这里,非中心是指相对零假设情形发生偏移的卡方分布。因为 rlnr(r1)r\ln r-(r-1) 永不为负,所以 μ3p0\mu_{3p}\geq 0

Writing ri=μi/bir_i = \mu_i / b_i, Eq. [eq:mu3p] becomes μ3p=2iMibi[rilnri(ri1)]\mu_{3p} = 2\sum_i M_i b_i [r_i \ln r_i - (r_i - 1)]. This is twice the per-pixel Poisson Kullback–Leibler divergence, summed over the fitting region. It is the Asimov location in a local likelihood-ratio approximation (Cowan et al. 2011). It does not mean that the finite-count, free-position distribution is exactly noncentral χ32\chi^2_3. Here noncentral means a chi-square distribution shifted away from its null case. Because rlnr(r1)r\ln r-(r-1) is never negative, μ3p0\mu_{3p}\geq0.

均值和方差采用不同阶次的近似。均值 μ3p\mu_{3p} 是主导的 Asimov 量。它把期望计数 Yi=μiY_i = \mu_i 代入 Cash 改进量。它不包含被拟合过程吸收的泊松波动。这些缺失行为包括有限位置搜索及其最大值。相比之下,方差 σ3p2\sigma^2_{3p} 包含对这种吸收效应的一阶修正。它使用第3.6 节中的 Fisher 投影。这个差异促使我们在低拟合信号下分别使用经验位置函数和宽度函数。位置参数可以移向局部向上的波动。这种最大值搜索行为在结构上类似有限的 look-elsewhere 效应 (Gross & Vitells 2010)。这里,该效应是指搜索多个位置时可能出现的增量。第 4 节中的配对检验只针对有界整数网格参考拟合器测量这一机制。第 5 节把流水线专属效应分开处理。

The mean and variance have different approximation orders. The mean μ3p\mu_{3p} is a leading Asimov quantity. It inserts the expected counts Yi=μiY_i = \mu_i into the Cash improvement. It does not include the Poisson fluctuations absorbed by the fit. This missing behavior includes the finite position search and its maximum. In contrast, the variance σ3p2\sigma^2_{3p} includes a first-order correction for this absorption. It uses the Fisher projection in Section 3.6. This difference motivates separate empirical location and scale functions at low fitted signal. Position parameters can move toward a local upward fluctuation. This maximum-search behavior is similar in structure to a finite look-elsewhere effect (Gross & Vitells 2010). Here this effect means the increase that can occur when many positions are searched. The paired test in Section 4 measures this mechanism only for the bounded integer-grid reference fitter. Section 5 keeps pipeline-specific effects separate.

Linearized score constraints

最佳拟合参数满足得分方程。对于任一拟合参数 θa{S,x,y}\theta_a \in \{S, x, y\},有

The best-fit parameters satisfy the score equations. For any fitted parameter θa{S,x,y}\theta_a \in \{S, x, y\},

dC/dθa=0dC/d\theta_a = 0

在拟合模型附近进行线性化,并写成

Linearizing around the fitted model, write

Yi=μi+ηi,E[ηi]=0,Var(ηi)=μi\begin{aligned} Y_{i} &= \mu_i + \eta_i, \\ E[\eta_i] &= 0, \\ \mathrm{Var}(\eta_i) &= \mu_i \end{aligned}

一阶得分约束为

The first-order score constraint is

iMi(dμi/dθa)ηi/μi=0\sum_i M_{i} (d\mu_i/d\theta_a)\, \eta_i / \mu_i = 0

共有三个这样的约束。

There are three such constraints:

dμi/dS=pi,dμi/dx=Ŝdpi/dx,dμi/dy=Ŝdpi/dy\begin{aligned} d\mu_i/dS &= p_{i}, \\ d\mu_i/dx &= \widehat{S}\, dp_i/dx, \\ d\mu_i/dy &= \widehat{S}\, dp_i/dy \end{aligned}

这些约束使三参数拟合不同于无约束的泊松和。拟合过程吸收沿幅度和位置方向的波动。计算残差方差时,我们必须去除这些方向。

These constraints make a three-parameter fit different from an unconstrained Poisson sum. The fit absorbs fluctuations along the amplitude and position directions. We must remove these directions when computing the residual variance.

ΔC\Delta C residual variance before projection

在固定源模型处,ΔC\Delta C 严格是独立泊松计数的线性组合。定义 a=2iMi(biμi)a=2\sum_iM_i(b_i-\mu_i)wi=2Miln(μi/bi)w_i=2M_i\ln(\mu_i/b_i)λi=μi\lambda_i=\mu_i。于是可得到下面的统计量、均值和方差。对于固定模型和任意固定像素权重 MiM_i,这些均值和方差表达式都是精确的。本文主要采用二元掩膜。对于固定模型,这些结果与 Kaastra (2017) 针对真实模型的 C 统计量所推导的均值和方差相同。第 4 节测量的是拟合模型情形。

At a fixed source model, ΔC\Delta C is exactly a linear combination of independent Poisson counts. Define a=2iMi(biμi)a=2\sum_iM_i(b_i-\mu_i), wi=2Miln(μi/bi)w_i=2M_i\ln(\mu_i/b_i), and λi=μi\lambda_i=\mu_i. Then ΔC=a+iwiYi,E[ΔC]=a+iλiwi=μ3p,Var(ΔC)=iλiwi2=4iMiμiln2(μibi).\begin{aligned} \Delta C &= a+\sum_iw_iY_i, \\ E[\Delta C] &= a+\sum_i\lambda_iw_i=\mu_{3p}, \\ \mathrm{Var}(\Delta C) &= \sum_i\lambda_iw_i^2 =4\sum_iM_i\mu_i\ln^2\!\left(\frac{\mu_i}{b_i}\right). \end{aligned} \label{eq:fixed-model-exact-moments} These mean and variance expressions are exact for a fixed model and any fixed pixel weights MiM_i. Binary masks are the main convention used here. For a fixed model, these are the same mean and variance that Kaastra (2017) derived for the C statistic of the true model. The fitted-model case is what Section 4 measures.

我们把式([eq:fixed-model-exact-moments])中的精确固定模型方差记为 σunc2\sigma^2_\mathrm{unc}。它是下文推导的投影方差 V3pV_{3p} 的第一项。然而,它不是拟合似然比的最终方差。它忽略了 SSxxyy 是通过最大化似然选出的。下文的 Fisher 投影会减去一个不可能为负的平方项。因此,在局部高斯近似中,σunc2\sigma^2_\mathrm{unc} 是投影方差的上限。

We denote the exact fixed-model variance in Equation ([eq:fixed-model-exact-moments]) by σunc2\sigma^2_\mathrm{unc}. It is the first term of the projected variance V3pV_{3p} derived below. However, it is not the final variance of the fitted likelihood ratio. It ignores that SS, xx, and yy were chosen to maximize the likelihood. The Fisher projection below subtracts a squared term that cannot be negative. Thus σunc2\sigma^2_\mathrm{unc} is an upper bound on the projected variance in the local Gaussian approximation.

Fisher projection for three fitted parameters

定义三个拟合参数的 Fisher 信息矩阵:

Define the Fisher information matrix for the three fitted parameters:

Iab=iMi(dμi/dθa)(dμi/dθb)/μiI_{ab} = \sum_i M_{i} (d\mu_i/d\theta_a)(d\mu_i/d\theta_b) / \mu_i

对于 θ=(S,x,y)\theta = (S,x,y),各矩阵元为

For θ=(S,x,y)\theta = (S,x,y), the entries are

ISS=iMipi2/μiISx=iMiŜpi(dpi/dx)/μiISy=iMiŜpi(dpi/dy)/μiIxx=iMiŜ2(dpi/dx)2/μiIxy=iMiŜ2(dpi/dx)(dpi/dy)/μiIyy=iMiŜ2(dpi/dy)2/μi\begin{aligned} I_{SS} &= \sum_i M_{i}\, p_{i}^2 / \mu_i \\ I_{Sx} &= \sum_i M_{i}\, \widehat{S}\, p_{i} (dp_i/dx) / \mu_i \\ I_{Sy} &= \sum_i M_{i}\, \widehat{S}\, p_{i} (dp_i/dy) / \mu_i \\ I_{xx} &= \sum_i M_{i}\, \widehat{S}^2 (dp_i/dx)^2 / \mu_i \\ I_{xy} &= \sum_i M_{i}\, \widehat{S}^2 (dp_i/dx)(dp_i/dy) / \mu_i \\ I_{yy} &= \sum_i M_{i}\, \widehat{S}^2 (dp_i/dy)^2 / \mu_i \end{aligned}

ΔC\Delta C 残差与得分方向 θa\theta_a 之间的协方差由下式编码。

The covariance between the ΔC\Delta C residual and the score direction θa\theta_a is encoded by

ga=iMilog(μi/bi)(dμi/dθa)g_{a} = \sum_i M_{i} \log(\mu_i/b_{i})\, (d\mu_i/d\theta_a)

显式写出为

Explicitly,

gS=iMipilog(μi/bi)gx=iMiŜ(dpi/dx)log(μi/bi)gy=iMiŜ(dpi/dy)log(μi/bi)\begin{aligned} g_{S} &= \sum_i M_{i}\, p_{i} \log(\mu_i/b_{i}) \\ g_{x} &= \sum_i M_{i}\, \widehat{S}\, (dp_i/dx) \log(\mu_i/b_{i}) \\ g_{y} &= \sum_i M_{i}\, \widehat{S}\, (dp_i/dy) \log(\mu_i/b_{i}) \end{aligned}

在高斯/Fisher 近似下,得分约束会去除残差沿拟合参数方向的投影。这是通常 Fisher/Wald 投影在成像问题中的形式。它来自多元高斯条件方差恒等式,其中 UU 表示线性化得分约束组成的向量。由此得到的方差为

Under the Gaussian/Fisher approximation, the score constraints remove the residual projection along the fitted parameters. This is the imaging form of the usual Fisher/Wald projection. It follows from the multivariate Gaussian conditional-variance identity: Var(RU=0)=Var(R)Cov(R,U)Var(U)1Cov(U,R),\mathrm{Var}(R\mid U=0)=\mathrm{Var}(R) -\mathrm{Cov}(R,U)\,\mathrm{Var}(U)^{-1}\,\mathrm{Cov}(U,R), where UU denotes the vector of linearized score constraints. The resulting variance is

V3pσ3p2=4[iMiμiln2(μibi)gTI1g]\boxed{ V_{3p}\equiv\sigma^2_{3p} =4\left[\sum_i M_i\mu_i\ln^2\left(\frac{\mu_i}{b_i}\right) -g^T I^{-1}g\right]} \label{eq:var3p}

式([eq:var3p]) 是核心解析结果。第一项是固定模型线性残差的方差。第二项去除再次拟合幅度和位置时吸收的波动。两项都使用拟合源模型、像素化 PSF、背景和掩膜。它们不使用注入幅度。

Equation ([eq:var3p]) is the central analytic result. The first term is the variance of the fixed-model linear residual. The second removes the fluctuation absorbed when amplitude and position are fitted again. Both terms use the fitted source model, pixelized PSF, background, and mask. They do not use an injected amplitude.

利用 Fisher 矩阵的分块结构,可以方便地计算投影 gTI1gg^T I^{-1}g。把它写成分块形式,其中 HH 包含 SS 与位置的交叉项。矩阵 KK2×22\times 2 位置块,对应 xxyy。投影可写成分块表达式。这里,gpos=(gx,gy)Tg_\mathrm{pos} = (g_x, g_y)^T。这个分块形式直接显示了位置投影。它也便于处理较大的 Ŝ\widehat{S}bb 网格。如果只拟合 SS,位置方向会消失。此时公式退化为只拟合幅度的单参数表达式。

The projection gTI1gg^T I^{-1}g can be computed conveniently via the block structure of the Fisher matrix. Writing I=(ISSHHTK),I = \begin{pmatrix} I_{SS} & H \\ H^T & K \end{pmatrix}, \label{eq:block-inverse-I} where HH contains the SS-position cross terms. The matrix KK is the 2×22\times2 position block for xx and yy. The projection becomes gTI1g=(gSHK1gpos)2/(ISSHK1HT)+gposTK1gpos,\begin{split} g^T I^{-1} g =&\; (g_{S} - H K^{-1} g_\mathrm{pos})^2 / (I_{SS} - H K^{-1} H^T) \\ &+ g_\mathrm{pos}^T K^{-1} g_\mathrm{pos}, \end{split} \label{eq:block-inverse-result} Here gpos=(gx,gy)Tg_\mathrm{pos} = (g_x, g_y)^T. This block form shows the position projection directly. It is also convenient for a large grid of Ŝ\widehat{S} and bb values. If only SS is fitted, the position directions disappear. The formula then reduces to the amplitude-only one-parameter expression.

Validity range of the variance approximation

方差 V3pV_{3p} 是拟合模型附近的局部高斯/Fisher 近似。当似然面在最大值附近接近抛物线时,它应当有效。拟合源还必须足够强,使位置拟合不会吸收孤立的泊松噪声结构。以 Ŝ\widehat{S} 为条件的方差检验见第 4.3 节和图 [fig:deltac-scatter-variance]。该节还给出低 Ŝ\widehat{S} 区域剩余宽度不足的整体修正。Fisher/Wilks 近似在 S=0S=0 边界失效。它们在低信号阈值带中也不完整。因此,我们在第 4 节测量剩余的位置和宽度修正。式([eq:var3p])单独使用时,不是一个已经在 DET_ML=6\mathrm{DET\_ML}=6–10 处验证的尾部分布模型。第 4.5 节说明,修正后的核已经在这个阈值带中得到验证。

The variance V3pV_{3p} is a local Gaussian/Fisher approximation around the fitted model. It should work when the likelihood surface is close to a parabola near its maximum. The fitted source must also be strong enough that position fitting does not absorb isolated Poisson noise features. The variance check conditioned on Ŝ\widehat{S} is presented in Section 4.3 and Figure [fig:deltac-scatter-variance]. That section also gives a global low-Ŝ\widehat{S} correction for the remaining width deficit. Fisher/Wilks approximations fail at the S=0S=0 boundary. They are also incomplete in the low-signal threshold band. We therefore measure the remaining location and width corrections in Section 4. By itself, Equation ([eq:var3p]) is not a validated tail model at DET_ML=6\mathrm{DET\_ML}=6–10. Section 4.5 shows that the corrected kernel is validated in this threshold band.

Matched Reference-Fitter Validation of Location and Scale

SAS emldetect 是闭源程序。它内部的像素化 PSF、优化器和搜索网格不能用于逐项理论检验。因此,我们构建了一个符合解析假设的参考拟合器。这个设计把两类误差分开。参考拟合器测量低 ΔC\Delta C 下的理论侧误差。与 emldetect 的比较随后测量新增的实现侧误差。

SAS emldetect is a closed program. Its internal pixelized PSF, optimizer, and search grid are unavailable for a term-by-term theory test. We therefore built a reference fitter that follows the analytic assumptions. This design separates two sources of error. The reference fitter measures theory-side error at low ΔC\Delta C. A comparison with emldetect then measures added implementation-side error.

表 [tab:assumption-checklist] 比较各拟合器的假设与理论。表中的“部分符合”表示拟合器具有所列特征,但并不符合每个数学细节。内部最优解远离所有参数边界。

Table [tab:assumption-checklist] compares the assumptions of each fitter with the theory. A “partial” entry means that the fitter has the named feature but does not match every mathematical detail. An interior optimum lies away from all parameter boundaries.

lll Independent Poisson pixels & Match: pixelwise likelihood & Match: same Poisson draws
Known constant background & Match: same scalar & Partial: map, exposure, and detector mask
Same PSF object in generation and fit & Match: same psfgen array & Partial: the ELLBETA PSF is sampled internally
Binary fitting mask & Match: Boolean circle & Partial: detector mask and fractional cut
Continuous interior (S,x,y)(S,x,y) optimum & Partial: position grid and bounded SS & Partial: interior status not saved
Maximum-likelihood fit & Match: best grid likelihood & Match: free-position likelihood fit

参考拟合器执行最大似然搜索。不过,它不是完全连续的三参数优化器。它检验一个 7×77\times 7 整数位置网格。在每个位置上,它在固定边界内拟合幅度。因此,低信号残差可能包含网格选择效应和边界效应。匹配实验仍是对式([eq:var3p])和低计数位置–宽度模型的主要检验。第 5 节测量额外的独立流水线差异。

The reference fitter performs a maximum-likelihood search. However, it is not a fully continuous three-parameter optimizer. It tests a 7×77\times7 integer position grid. At each position, it fits an amplitude within fixed bounds. Low-signal residuals can therefore contain grid selection and boundary effects. The matched experiment remains the main test of Equation ([eq:var3p]) and the low-count location–scale model. Section 5 measures the added standalone-pipeline difference.

Simulation design

模拟覆盖 17 个探测器位置、8 个注入幅度和 6 个背景水平。每个网格单元有 1000 次实现。整个设计包含 816,000 次拟合。位置–宽度分析保留了 810,987 行干净数据。我们要求 Ŝ>0.5\widehat S>0.5V3p>0.01V_{3p}>0.01、各矩为有限值且拟合成功。这些规则移除 5,013 行,占完整样本的 0.6%。大多数被移除的行具有很低的拟合幅度,此时投影方差发生退化。V3p>0.01V_{3p}>0.01 规则移除了这种不稳定归一化。

The simulations span 17 detector positions, eight injected source strengths, and six background levels. Each grid cell has 1000 realizations. The design contains 816,000 fits. The location–scale analysis retains 810,987 clean rows. We require Ŝ>0.5\widehat S>0.5, V3p>0.01V_{3p}>0.01, finite moments, and successful fits. These rules remove 5,013 rows, or 0.6% of the full sample. Most removed rows have very low fitted amplitude, where the projected variance becomes degenerate. The V3p>0.01V_{3p}>0.01 rule removes this unstable normalization.

我们在 XMM-Newton SAS v20.0.0 中用 psfgen 生成了像素化 PN 第 4 波段 PSF 模板。匹配的源拟合不调用 emldetect。它们使用整数网格位置搜索、有界的标量幅度拟合,以及半径为 15 像素(60 角秒)的圆形拟合掩膜。该掩膜对应 emldetect 参数 𝚎𝚌𝚞𝚝=15\mathtt{ecut}=15。参考拟合器验证保留每个探测器位置。对于独立运行的比较,我们从目录的 DET_ML\mathrm{DET\_ML} 列读取经验统计量。我们用 ΔCeml=2Qx1(1.5,exp(DET_ML))\Delta C_\mathrm{eml} = 2\,Q_x^{-1}(1.5,\exp(-\mathrm{DET\_ML})) 进行转换,并采用 ν=3\nu=3

We generated the pixelized PN band 4 PSF templates with psfgen under XMM-Newton SAS v20.0.0. The matched source fits do not call emldetect. They use an integer-grid position search, bounded scalar amplitude fitting, and a circular fitting mask with radius 15 pixels (60 arcsec). This mask corresponds to the emldetect parameter 𝚎𝚌𝚞𝚝=15\mathtt{ecut}=15. The reference-fitter validation keeps every detector position. For standalone comparisons, we read the empirical statistic from the catalog DET_ML\mathrm{DET\_ML} column. We convert it using ΔCeml=2Qx1(1.5,exp(DET_ML))\Delta C_\mathrm{eml} = 2\,Q_x^{-1}(1.5,\exp(-\mathrm{DET\_ML})) with ν=3\nu=3.

每个模拟源都用三参数泊松似然进行拟合。对于每一行,我们在拟合幅度处计算理论。

Each simulated source is fitted with a three-parameter Poisson likelihood. For every row, we evaluate the theory at the fitted source strength:

μ3p=μAsimov(Ŝ,b,psf,mask)E[ΔCŜ,b,psf,mask],V3p=VarFisher[ΔC|Ŝ,b,psf,mask]\begin{aligned} \mu_{3p} &= \mu_\mathrm{Asimov}(\widehat S,b,\mathrm{psf},\mathrm{mask}) \simeq E[\Delta C\mid\widehat S,b,\mathrm{psf},\mathrm{mask}], \\ V_{3p} &= \mathrm{Var}_\mathrm{Fisher}[\Delta C | \widehat{S}, b, \mathrm{psf}, \mathrm{mask}] \end{aligned}

这里,μ3p\mu_{3p} 是预测的三参数位置,V3pV_{3p} 是它的 Fisher 投影方差。我们把诊断残差定义为

Here μ3p\mu_{3p} is the predicted three-parameter location, and V3pV_{3p} is its Fisher-projected variance. We define the diagnostic residual as

Z0=(ΔCobsμ3p)/V3p.Z_0 = (\Delta C_{\mathrm{obs}} - \mu_{3p}) / \sqrt{V_{3p}}.

这个原始标准化残差以预测标准差为单位。验证以可观测量为条件。预测使用拟合幅度 Ŝ\widehat{S},而不是注入幅度 StrueS_\mathrm{true}

This raw standardized residual is measured in units of the predicted standard deviation. The validation is conditioned on observables. The prediction uses the fitted amplitude Ŝ\widehat{S}, not the injected amplitude StrueS_\mathrm{true}.

图 [fig:deltac-scatter-variance] 是匹配实验的主要原始数据检查。它展示模型所需的三个事实。像素求和位置跟随主要均值趋势。剩余的低信号偏移是平滑的。高信号下,Fisher 投影宽度接近观测宽度。各行表示三个有代表性的探测器半径。颜色表示五个背景。右列是主要方差检查。它测量 ΔCμ3p\Delta C-\mu_{3p} 的标准差,而不是原始 ΔC\Delta C 的标准差。因此,分箱内的均值梯度不会表现为额外宽度。虚线使用式([eq:mean-corr])和式([eq:sigma-corr])中的均值与宽度修正。下文定义它们的归一化函数 F(μ3p)F(\mu_{3p})G(μ3p)G(\mu_{3p})

Figure [fig:deltac-scatter-variance] is the main raw-data check for the matched experiment. It shows three facts required by the model. The pixel-sum location follows the main mean trend. The remaining low-signal shift is smooth. The Fisher-projected scale approaches the observed width at high signal. Rows show three representative detector radii. Colors show five backgrounds. The right column is the main variance check. It measures the standard deviation from ΔCμ3p\Delta C-\mu_{3p}, not from raw ΔC\Delta C. Thus a mean gradient within a bin does not appear as extra width. Dashed curves use the mean and width corrections in Equations ([eq:mean-corr]) and ([eq:sigma-corr]). We define their normalized F(μ3p)F(\mu_{3p}) and G(μ3p)G(\mu_{3p}) functions below.

Reference-fitter validation results

表 [tab:ref-fitter-validation] 给出低信号和高信号情形。在高信号下(Ŝ>20\widehat S>20),按实现重采样时,标准化残差的均值为 0.068±0.0020.068\pm 0.002,宽度为 0.977±0.0010.977\pm 0.001。对应的位置重采样误差分别为 ±0.006\pm 0.006±0.002\pm 0.002。因此,Asimov 位置和投影宽度与匹配模型一致。在 Ŝ<5\widehat S<5 时,以预测标准差为单位的均值为 0.922±0.0020.922\pm 0.002(按位置重采样为 ±0.011\pm 0.011)。宽度为 0.856±0.0020.856\pm 0.002(按位置重采样为 ±0.003\pm 0.003)。因此,低计数模型必须分别修正位置和宽度。

Table [tab:ref-fitter-validation] gives low- and high-signal cases. At high signal (Ŝ>20\widehat S>20), the standardized residual has mean 0.068±0.0020.068\pm0.002 and width 0.977±0.0010.977\pm0.001 under realization resampling. The position-resampling errors are ±0.006\pm0.006 and ±0.002\pm0.002, respectively. Thus the Asimov location and projected scale agree with the matched model. At Ŝ<5\widehat S<5, the mean is 0.922±0.0020.922\pm0.002, in units of the predicted standard deviation (±0.011\pm0.011 by position). The width is 0.856±0.0020.856\pm0.002 (±0.003\pm0.003 by position). A low-count model must therefore correct location and scale separately.

自助重采样通过从已有各次实现或探测器位置中反复抽样来测量抽样不确定性。表中报告这两类不确定性。

Bootstrap resampling measures sampling uncertainty by repeatedly drawing from the available realizations or detector positions. We report both types in the table.

lrrr Ŝ<5\widehat{S}<5 & 137,310 & +0.922±0.002+0.922\pm0.002 (±0.011\pm0.011 by position) & 0.856±0.0020.856\pm0.002 (±0.003\pm0.003 by position)
Ŝ>20\widehat{S}>20 & 266,837 & +0.068±0.002+0.068\pm0.002 (±0.006\pm0.006 by position) & 0.977±0.0010.977\pm0.001 (±0.002\pm0.002 by position)

Low-count location–scale kernel

先定义下面所示的原始归一化残差。标定把它的位置和宽度估计为 μ3p\mu_{3p} 的函数;这个量是可观测的期望似然强度。我们使用 μ3p\mu_{3p},因为它是能描述低计数趋势的最简单拟合可观测量坐标。这个选择出于实用考虑,不是推导结果。函数 FF 给出归一化均值偏移。函数 GG 给出归一化宽度。我们优先采用下面给出的紧凑形式和两组系数。每个函数有三个拟合系数。我们用相同的 749,863 行数据拟合两个函数。因此,这些拟合是样本内描述。下一小节的留出阈值检验是独立检查。所示系数误差为标准误。计算使用数据发布文件中的全精度系数。

Define the raw normalized residual Z0=ΔCμ3pV3p.Z_0=\frac{\Delta C-\mu_{3p}}{\sqrt{V_{3p}}}. The calibration estimates its location and scale as functions of μ3p\mu_{3p}, the observable expected likelihood strength. We use μ3p\mu_{3p} because it is the simplest fitted-observable coordinate that captures the low-count trend. This choice is practical, not derived. The function FF gives the normalized mean shift. The function GG gives the normalized width. Our preferred compact forms are F(μ)=AF1+(μ/μF)pF,G(μ)=1AG1+(μ/μG)pG,\begin{aligned} F(\mu) &= \frac{A_F}{1+(\mu/\mu_F)^{p_F}}, \\ G(\mu) &= 1-\frac{A_G}{1+(\mu/\mu_G)^{p_G}}, \label{eq:fg-kernel} \end{aligned} with (AF,μF,pF)=(1.530±0.042,4.944±0.266,0.9711±0.0132)(A_F,\mu_F,p_F)=(1.530\pm0.042,4.944\pm0.266,0.9711\pm0.0132) and (AG,μG,pG)=(0.2484±0.0077,14.39±0.92,1.184±0.044).(A_G,\mu_G,p_G)=(0.2484\pm0.0077,14.39\pm0.92,1.184\pm0.044). Each function has three fitted coefficients. We fitted both functions to the same 749,863 rows. These fits are therefore in-sample descriptions. The out-of-sample threshold test in the next subsection is the independent check. The displayed coefficient errors are standard errors. Calculations use the full-precision coefficients in the data release.

拟合给每个分箱的权重等于该分箱标准误平方的倒数。我们只在 μ3p3.0\mu_{3p}\geq 3.0 时拟合紧凑函数。这会排除 61,124 行,占干净样本的 7.54%。这些行的 ΔC\Delta C 远低于 DET_ML=6\mathrm{DET\_ML}=6 阈值。第 4.5 节说明,它们的残差不是高斯分布。纳入这些行后,在 DET_ML=6\mathrm{DET\_ML}=6–10 带内,GG 最多改变 0.00382,FF 最多改变 0.00450。

The fit gives each bin a weight equal to the inverse squared standard error of that bin. We fit the compact functions only on μ3p3.0\mu_{3p}\geq3.0. This excludes 61,124 rows, or 7.54% of the clean sample. Their ΔC\Delta C values lie far below the DET_ML=6\mathrm{DET\_ML}=6 threshold. Their residual is not Gaussian, as shown in Section 4.5. Including these rows changes GG by at most 0.00382 in the DET_ML=6\mathrm{DET\_ML}=6–10 band and FF by at most 0.00450.

因此,条件位置和宽度如下。加权均方根误差(RMSE)使用 32 个 μ3p\mu_{3p} 分箱,每个分箱按其中的行数加权。按实现重采样时,FF 的 RMSE 为 0.00946±0.001040.00946\pm 0.00104GG 的 RMSE 为 0.00437±0.000650.00437\pm 0.00065。对应的位置重采样误差分别为 ±0.00092\pm 0.00092±0.00069\pm 0.00069。随着 μ3p\mu_{3p} 增大,两个函数都趋近 Fisher 极限,即 F0F\rightarrow 0G1G\rightarrow 1。低计数位置偏移类似于 Stewart (2009) 讨论的经验加性偏移。不过,我们的偏移不是常数,也不被解释为同一种修正。

The conditional location and width are therefore μΔCcorr=μ3p+V3pF(μ3p),σΔCcorr=V3pG(μ3p).\begin{aligned} \mu_{\Delta C}^\mathrm{corr} &=\mu_{3p}+\sqrt{V_{3p}}\,F(\mu_{3p}), \label{eq:mean-corr}\\ \sigma_{\Delta C}^\mathrm{corr} &=\sqrt{V_{3p}}\,G(\mu_{3p}). \label{eq:sigma-corr} \end{aligned} The weighted root-mean-square error (RMSE) uses 32 μ3p\mu_{3p} bins. Each bin is weighted by its number of rows. The RMSE is 0.00946±0.001040.00946\pm0.00104 for FF and 0.00437±0.000650.00437\pm0.00065 for GG under realization resampling (position-resampling errors: ±0.00092\pm0.00092 and ±0.00069\pm0.00069, respectively). Both functions approach the Fisher limits, F0F\rightarrow0 and G1G\rightarrow1, as μ3p\mu_{3p} increases. The low-count location shift resembles the empirical additive offset discussed by Stewart (2009). However, our shift is not constant and is not interpreted as the same correction.

image image

Threshold validation on held-out data

我们使用对应 DET_ML=6\mathrm{DET\_ML}=6、8 和 10 的固定 ΔC\Delta C 值。不按观测到的 DET_ML\mathrm{DET\_ML}ΔC\Delta C 或残差选择任何数据行。在 realization block 划分中,每个网格单元的 1000 次实现按实现编号分为五块。四块用于拟合核,剩下一块用于检验。每一块都轮流留出。在三个阈值上,未修正 Fisher 核的平均绝对误差为 0.01359±0.000100.01359\pm 0.00010。加入位置修正后,误差降至 0.00243±0.000090.00243\pm 0.00009。同时加入两项修正后,误差降至 0.00199±0.000080.00199\pm 0.00008。最后一个值接近 0.00196±0.000080.00196\pm 0.00008 的经验分箱基准。留一位置和留一背景检验给出相同的排序(表 [tab:kernel-oos])。

We use fixed ΔC\Delta C values for DET_ML=6\mathrm{DET\_ML}=6, 8, and 10. No row is selected by observed DET_ML\mathrm{DET\_ML}, ΔC\Delta C, or a residual. In the realization-block split, the 1000 realizations in each grid cell are divided by their realization number into five blocks. Four blocks fit the kernel, and the remaining block tests it. Each block is held out in turn. Across the three thresholds, the mean absolute error is 0.01359±0.000100.01359\pm0.00010 for the uncorrected Fisher kernel. It falls to 0.00243±0.000090.00243\pm0.00009 after the location correction and 0.00199±0.000080.00199\pm0.00008 after both corrections. The last value is close to the 0.00196±0.000080.00196\pm0.00008 empirical-bin benchmark. Leave-one-position-out and leave-one-background-out tests give the same ordering (Table [tab:kernel-oos]).

标准误取 1000 次自助重采样重复结果中央 68% 区间宽度的一半。有放回重采样会重复一些数据行。因此,绝对误差指标的自助重采样均值略高于点估计。我们报告标准误,而不是这个发生偏移的均值。

The standard error is half the central 68% range of 1000 bootstrap replicates. Resampling with replacement duplicates some rows. The bootstrap mean of an absolute-error metric is therefore slightly above the point estimate. We quote the standard error, not that shifted mean.

lrrrr Realization block: point estimate ±\pm SE & 0.01359±0.000100.01359\pm0.00010 & 0.00243±0.000090.00243\pm0.00009 & 0.00199±0.000080.00199\pm0.00008 & 0.00196±0.000080.00196\pm0.00008
Position-resampling SE & ±0.00011\pm0.00011 & ±0.00010\pm0.00010 & ±0.00008\pm0.00008 & ±0.00008\pm0.00008
Leave one position out & 0.0136 & 0.00276 & 0.00227 & 0.00225
Leave one background out & 0.0136 & 0.00255 & 0.00214 & 0.00215

位置修正带来最大的改进。宽度项带来较小但已测得的增益。按实现重采样时,配对 MAE 降低量为 0.00044±0.000050.00044\pm 0.00005;按位置重采样时为 ±0.00007\pm 0.00007。两项增益都超过六个标准误。修正结果几乎达到不使用拟合曲线的经验单元基准。这个结果标定了匹配参考拟合器中的过阈概率。它并不表明变换后的 DET_ML\mathrm{DET\_ML} 值服从高斯分布。它也不是固定 StrueS_\mathrm{true} 下的注入完备度测量。

The location correction gives the largest improvement. The width term gives a smaller but measured gain. The paired MAE decrease is 0.00044±0.000050.00044\pm0.00005 under realization resampling (±0.00007\pm0.00007 by position). Both gains exceed six standard errors. The corrected result nearly reaches the empirical cell benchmark, which uses no fitted curve. This result calibrates threshold-passing probabilities in the matched reference fitter. It does not show that transformed DET_ML\mathrm{DET\_ML} values are Gaussian. It is also not an injection-completeness measurement at fixed StrueS_\mathrm{true}.

Residual shape and percentile calibration

校正后的残差为 Zcorr=(Z0F)/GZ_\mathrm{corr}=(Z_0-F)/G。在全部 810,987 行干净数据中,它的均值为 +0.00510+0.00510,标准差为 1.002。它的偏度为 0.0158;偏度衡量分布的不对称性。超额峰度衡量相对正态分布的尾部重量和峰形。在三个较宽的 μ3p\mu_{3p} 区间中,偏度范围为 0.0455-0.0455 到 0.0957。超额峰度范围为 0.0980-0.0980 到 0.114。

The corrected residual is Zcorr=(Z0F)/GZ_\mathrm{corr}=(Z_0-F)/G. Across all 810,987 clean rows, its mean is +0.00510+0.00510, and its standard deviation is 1.002. Its skewness is 0.0158, where skewness measures asymmetry. Excess kurtosis measures tail weight and peak shape relative to a normal distribution. Across the three broad μ3p\mu_{3p} bands, skewness ranges from 0.0455-0.0455 to 0.0957. Excess kurtosis ranges from 0.0980-0.0980 to 0.114.

表 [tab:percentile-calibration] 给出检验的六个百分位。在阈值带内,最大偏差为 0.684 个百分点。第 2.3 和第 10 百分位分别相差 0.408 和 0.108 个百分点。在三个较宽区间和合并样本中,这两个低尾部偏差都不超过 0.619 个百分点。

Table [tab:percentile-calibration] gives all six tested percentiles. In the threshold band, the largest departure is 0.684 percentage points. The 2.3th and 10th percentiles differ by 0.408 and 0.108 percentage points. Across the three broad bands and the pooled sample, these two lower-tail departures never exceed 0.619 percentage points.

lrrrrrr <10<10 & 2.427±0.0342.427\pm0.034 & 9.381±0.0649.381\pm0.064 & 15.114±0.07515.114\pm0.075 & 49.225±0.10649.225\pm0.106 & 83.109±0.08483.109\pm0.084 & 89.549±0.06589.549\pm0.065
10104040 & 1.892±0.0261.892\pm0.026 & 9.892±0.0539.892\pm0.053 & 16.245±0.06916.245\pm0.069 & 50.684±0.09250.684\pm0.092 & 83.684±0.07283.684\pm0.072 & 89.588±0.05789.588\pm0.057
>40>40 & 2.290±0.0272.290\pm0.027 & 10.234±0.05310.234\pm0.053 & 16.261±0.06216.261\pm0.062 & 50.032±0.08550.032\pm0.085 & 83.987±0.06483.987\pm0.064 & 90.095±0.04990.095\pm0.049

宽信号带偏度的绝对值小于 0.096,超额峰度的绝对值小于 0.114。最强的非高斯形状出现在 μ3p<1\mu_{3p}<1 时,此时偏度约为 1.5-1.5。这远低于 DET_ML=6\mathrm{DET\_ML}=6 阈值,该阈值处的 μ3p\mu_{3p} 约为 14。因此,对于匹配的 PN 第 4 波段核,第 6 节中的低百分位穿越得到支持。图 [fig:residual-shape-calibration] 总结形状和百分位检查。

The broad-band skewness has magnitude below 0.096, and the excess kurtosis has magnitude below 0.114. The strongest non-Gaussian shape occurs at μ3p<1\mu_{3p}<1, where the skewness reaches about 1.5-1.5. This is far below the DET_ML=6\mathrm{DET\_ML}=6 threshold, where μ3p\mu_{3p} is about 14. Therefore, the lower-percentile crossings in Section 6 are supported for the matched PN band 4 kernel. Figure [fig:residual-shape-calibration] summarizes the shape and percentile checks.

image

The mean correction does not determine the width

FFGG 都随 μ3p\mu_{3p} 变化。因此,它们在合并数据中表现出很强的关联。我们检验了拟合均值修正的仿射函数,即直线函数。该检验询问它能否替代独立拟合的 G(μ3p)G(\mu_{3p})。去除共同的 μ3p\mu_{3p} 趋势后,位置与宽度之间的 Spearman 相关系数在全部数据中为 0.0465-0.0465,在 5μ3p405\leq\mu_{3p}\leq 40 时为 +0.0420+0.0420。这种较弱的秩关联是两个修正相互独立的主要证据。

Both FF and GG vary with μ3p\mu_{3p}. They therefore show a strong pooled association. We tested an affine, or straight-line, function of the fitted mean correction. The test asks whether it can replace the independently fitted G(μ3p)G(\mu_{3p}). After removing the common μ3p\mu_{3p} trend, the Spearman correlations between location and width are 0.0465-0.0465 overall and +0.0420+0.0420 for 5μ3p405\leq\mu_{3p}\leq40. This weak ranked association is the main evidence that the two corrections are separate.

在 17 个留出的整位置组中,独立宽度模型和均值关联模型在归一化 GG 单位下的宽度 RMSE 分别为 0.0409 和 0.0455。二者的比值为 1.11,各位置的比值范围为 1.07 到 1.17。比值为 1 表示留出误差相同。我们在查看结果前选择了 1.10 的上限。它允许较小模型最多损失 10%。这是实际容差,不是从数据推导出的规律。估计宽度前必须先对均值建模,因为均值用于去除梯度。不过,宽度需要自己的修正函数。这个分组检验复用了参考样本。它比较不同模型,但不是独立的确认数据集。

Across 17 held-out whole-position groups, the independent and mean-linked models give width RMSE values of 0.0409 and 0.0455 in normalized GG units. Their ratio is 1.11, with position-wise ratios from 1.07 to 1.17. A ratio of one would mean equal held-out errors. We chose the limit of 1.10 before inspecting the result. It allows at most a 10% loss from the smaller model. This is a practical tolerance, not a law inferred from the data. The mean must be modeled before estimating the width because it removes gradients. However, the width needs its own correction function. This grouped test reuses the reference sample. It compares models but is not an independent confirmation data set.

Mechanism and configuration boundary

一项有针对性的配对重运行保存了四个似然分量:oracle、只拟合幅度、重定位位置和完整拟合。oracle 分量只在这个模拟诊断中使用 StrueS_\mathrm{true}。它在注入幅度和位置处计算固定模型。重运行包含 4 个探测器位置上的 96,000 次拟合。在 μ3p<10\mu_{3p}<10 的 49,193 行干净数据中,幅度拟合贡献 +0.838±0.005+0.838\pm 0.005ΔC\Delta C 单位。质心重定位和位置最大化贡献 +2.099±0.008+2.099\pm 0.008ΔC\Delta C 单位。负的 oracle 噪声项和拟合条件项抵消了该增益的大部分。因此,拟合后的总偏移为 +0.692±0.004+0.692\pm 0.004ΔC\Delta C 单位。这些误差是 realization 聚类标准误。对应的位置聚类误差为 0.012、0.047 和 0.017。

A targeted paired rerun saved four likelihood components: oracle, amplitude-only, relocated-position, and full fits. The oracle component uses StrueS_\mathrm{true} only for this simulation diagnostic. It evaluates the fixed model at the injected amplitude and position. The rerun contains 96,000 fits across four detector positions. Among 49,193 clean rows with μ3p<10\mu_{3p}<10, amplitude fitting contributes +0.838±0.005+0.838\pm0.005 in ΔC\Delta C units. Centroid relocation and position maximization contribute +2.099±0.008+2.099\pm0.008 in ΔC\Delta C units. Negative oracle-noise and fitted-conditioning terms cancel much of this gain. The total fitted shift is therefore +0.692±0.004+0.692\pm0.004 in ΔC\Delta C units. These are realization-cluster standard errors. The corresponding position-cluster errors are 0.012, 0.047, and 0.017.

原始正贡献预算为 0.838+2.099=2.940.838+2.099=2.94ΔC\Delta C 单位。这接近三个拟合参数的 Wilks 期望 3 (Wilks 1938)。预期的拆分约为幅度贡献 1,两个位置坐标贡献 2。这是一种解释,不是推导结果。有限计数下非平凡的部分,是以拟合幅度为条件后仍保留的 +0.692+0.692。宽度不足没有闭式表达。该结果支持整数网格参考拟合器中的有限位置最大值搜索解释。其结构类似 look-elsewhere 行为 (Gross & Vitells 2010)。这不能证明连续拟合或独立运行的 emldetect 具有相同的分量收支。

The raw positive budget is 0.838+2.099=2.940.838+2.099=2.94 in ΔC\Delta C units. This is close to the Wilks expectation of 3 for three fitted parameters (Wilks 1938). The expected split is about 1 for amplitude and 2 for the two position coordinates. This is an interpretation, not a derived result. The nontrivial finite-count part is the +0.692+0.692 that remains after conditioning on fitted amplitude. No closed form is available for the width deficit. The result supports a finite-position maximum-search explanation in the integer-grid reference fitter. Its structure is similar to look-elsewhere behavior (Gross & Vitells 2010). It does not establish the same component budget for continuous fitting or standalone emldetect.

在匹配的 PN 第 4 波段配置内,紧凑的 μ3p\mu_{3p} 核留下的位置 RMS 趋势在不同位置间为 0.0073,在不同背景间为 0.0377。这种稳定性只适用于已检验配置。它不能使这些系数成为通用系数。式([eq:master-kernel])中的索引 kk 包括 PSF 制备、拟合掩膜、搜索范围和优化器。第 5 节表明,改变这些选择会改变 FkF_k 的符号和宽度 GkG_k

Within the matched PN band 4 configuration, the compact μ3p\mu_{3p} kernel leaves RMS location trends of 0.0073 across positions. The trend is 0.0377 across backgrounds. This stability applies only within the tested configuration. It does not make the coefficients universal. The index kk in Equation ([eq:master-kernel]) includes PSF preparation, fitting mask, search range, and optimizer. Section 5 shows that changing these choices can change the sign of FkF_k and the scale GkG_k.

What the matched validation establishes

只有高信号一致性不足以证明阈值用途合理。对于当前 PN 第 4 波段配置,DET_ML=6\mathrm{DET\_ML}=6–10 大多位于 Ŝ=20\widehat S=20 以下。第 4.4 节的留出检验针对匹配参考拟合器弥补了这一缺口。它们在已检验的阈值范围内验证了紧凑的位置–宽度核。它们不能证明更低信号下具有精确的高斯尾部。它们也不能证明其他优化器或 PSF 约定的行为。

High-signal agreement alone would not justify threshold use. For the current PN band 4 configuration, DET_ML=6\mathrm{DET\_ML}=6–10 lies mostly below Ŝ=20\widehat S=20. The held-out tests in Section 4.4 address this gap for the matched reference fitter. They validate the compact location–scale kernel over the tested threshold range. They do not establish an exact Gaussian tail at any smaller signal. They also do not establish the behavior of another optimizer or PSF convention.

端到端假源注入仍是测量巡天绝对完备度的正确方法。它包括候选体生成、源混淆、背景图构建和流水线的每个筛选条件。现代的模拟标定巡天分析采用这种方法 (Brunner et al. 2022; Liu et al. 2022)。解析公式有不同的目的。式([eq:mu3p]) 和式([eq:var3p]) 保留对背景、PSF 和掩膜的连续依赖。随后,匹配模拟标定两个无量纲函数 FkF_kGkG_k。它不需要在每个位置和流量处列出密集的完整分布。第 5 节检验独立运行的 emldetect 所需的额外信息。

End-to-end fake-source injection remains the correct method for absolute survey completeness. It includes candidate generation, source confusion, background-map construction, and every pipeline cut. Modern simulation-calibrated survey analyses use this approach (Brunner et al. 2022; Liu et al. 2022). The analytic formula has a different purpose. Equations ([eq:mu3p]) and ([eq:var3p]) keep the continuous dependence on background, PSF, and mask. A matched simulation then calibrates two dimensionless functions, FkF_k and GkG_k. It need not tabulate a dense distribution at every position and flux. Section 5 tests the extra information needed for standalone emldetect.

Pipeline-Specific Calibration and Transfer Boundary

匹配参考拟合器把统计理论单独分离出来。不过,emldetect 使用不同的优化器、内部像素化 PSF、搜索面和掩膜约定。我们把独立运行的 PN 第 4 波段实验作为标定案例。第一个结果是依赖位置的均值穿越标定。它不是绝对完备度测量。第二个结果是转移检验。它表明,不能假定该标定或参考拟合器的 FFGG 系数适用于其他相机、波段或搜索配置。

The matched reference fitter isolates the statistical theory. However, emldetect uses a different optimizer, internal pixelized PSF, search surface, and mask convention. We use the standalone PN band 4 experiment as a calibration case study. The first result is a position-dependent calibration of the mean crossing. It is not an absolute completeness measurement. The second result is a transfer test. It shows that neither this calibration nor the reference-fitter FF and GG coefficients can be assumed for another camera, band, or search configuration.

PN band 4 mean residual calibration

原始理论给出 Asimov 位置。左侧是预测的三参数均值。它取决于拟合幅度、局部背景、像素化 PSF 和拟合掩膜。如果独立运行的 emldetect 与该模型完全一致,阈值极限就由下一方程给出。这里右侧是 ΔCth\Delta C_{\mathrm{th}},即 Cash 改进量阈值。实际中,未标定误差随位置变化,而不是一个常数偏移。第 5.2 节给出数值误差。

The raw theory supplies the Asimov location μ3p(Ŝ,b,psf,mask)E[ΔCŜ,b,psf,mask]\mu_{3p}(\widehat S,b,\mathrm{psf},\mathrm{mask}) \simeq E[\Delta C\mid\widehat S,b,\mathrm{psf},\mathrm{mask}] The left side is the predicted three-parameter mean. It depends on the fitted source amplitude, local background, pixelized PSF, and fitting mask. If standalone emldetect exactly matched this model, the threshold limit would follow from μ3p(Slim,b,psf,mask)=ΔCth\mu_{3p}(S_{\mathrm{lim}},b,\mathrm{psf},\mathrm{mask}) = \Delta C_{\mathrm{th}} Here the right side is ΔCth\Delta C_{\mathrm{th}}, the Cash-improvement threshold. In practice, the uncalibrated error varies with position. It is not one constant offset. Section 5.2 gives the numerical errors.

[fig:emldetect-scatter-variance] 是对独立运行的 emldetect 链的主要检查。它的格式与图[fig:deltac-scatter-variance] 相同。以可观测量为条件的结构仍然可见。不过,相对于参考拟合器理论,独立流水线增加了依赖位置的残差。因此,该图说明最终标定需要两部分:解析方程和经验 RemlR_\mathrm{eml} 修正。

Figure [fig:emldetect-scatter-variance] is the main check for the standalone-emldetect chain. It has the same format as Figure [fig:deltac-scatter-variance]. The observable-conditioned structure remains visible. However, the standalone pipeline adds a position-dependent residual relative to the reference-fitter theory. The figure therefore motivates two parts in the final calibration: the analytic equation and an empirical RemlR_\mathrm{eml} correction.

因此,我们把独立运行的 emldetect 残差定义为

We therefore define the standalone emldetect residual as

Reml=ΔCemlμ3p(Ŝeml,b,psf,mask)R_{\mathrm{eml}} = \Delta C_{\mathrm{eml}} - \mu_{3p}(\widehat{S}_{\mathrm{eml}},b,\mathrm{psf},\mathrm{mask}) \label{eq:reml}

这里,ΔCeml\Delta C_\mathrm{eml} 是独立运行的 emldetect Cash 改进量。我们按照单图像 ν=3\nu=3 约定转换它。Ŝeml\widehat{S}_\mathrm{eml}emldetect 的拟合幅度。标定后的阈值方程为

Here ΔCeml\Delta C_\mathrm{eml} is the standalone emldetect Cash improvement. We convert it with the single-image ν=3\nu=3 convention. The quantity Ŝeml\widehat{S}_\mathrm{eml} is the fitted emldetect source amplitude. The calibrated threshold equation is

μ3p(Slim,b,psf,mask)=ΔCthR̂eml\mu_{3p}(S_{\mathrm{lim}},b,\mathrm{psf},\mathrm{mask}) = \Delta C_{\mathrm{th}} - \widehat{R}_{\mathrm{eml}} \label{eq:sensitivity-limit}

符号由残差定义决定。如果 R̂eml>0\widehat{R}_\mathrm{eml}>0,那么在相同拟合幅度下,独立运行的 emldetect 给出的 ΔC\Delta C 大于原始理论。此时,灵敏度极限所需的理论阈值更低。如果 R̂eml<0\widehat{R}_\mathrm{eml}<0,所需源幅度更高。

The sign follows from the residual definition. If R̂eml>0\widehat{R}_\mathrm{eml}>0, standalone emldetect gives a larger ΔC\Delta C than the raw theory at the same fitted strength. The theoretical threshold needed for the sensitivity limit is then lower. If R̂eml<0\widehat{R}_\mathrm{eml}<0, the required source amplitude is higher.

标定使用配对假源模拟。我们同时用参考拟合器和独立运行的 SAS emldetect 分析每次实现。排除边缘案例后,网格包含 14 个 PN 第 4 波段位置。我们用式([eq:detml-inverse])在 ΔC\Delta C 空间中定义目标阈值带。数据行按下面的参考理论预测选择。阈值样本不按观测到的 DET_MLeml\mathrm{DET\_ML}_\mathrm{eml}ΔCeml\Delta C_\mathrm{eml} 选择。这两个值都包含正被标定的随机波动和实现残差。我们改用以可观测量为条件的理论给出的预测参考 ΔC\Delta C 进行选择。我们在 b=0.04countspixel1b = 0.04\,\mathrm{counts\,pixel^{-1}} 处构建基线标定网格。下文的不确定性收支包括向 b=0.02b=0.02b=0.08countspixel1b=0.08\,\mathrm{counts\,pixel^{-1}} 的转移。

The calibration uses paired fake-source simulations. We analyze every realization with both the reference fitter and standalone SAS emldetect. After excluding the edge case, the grid has 14 PN band 4 positions. We define the target threshold band in ΔC\Delta C space with Equation ([eq:detml-inverse]). Rows are selected by the reference-theory prediction: μ3p,ref[ΔCML6,ΔCML10]\mu_{3p,\mathrm{ref}} \in [\Delta C_{\mathrm{ML6}}, \Delta C_{\mathrm{ML10}}] The threshold sample is not selected by observed DET_MLeml\mathrm{DET\_ML}_\mathrm{eml} or observed ΔCeml\Delta C_\mathrm{eml}. Both values contain the random fluctuation and implementation residual being calibrated. Instead, selection uses the predicted reference ΔC\Delta C from the observable-conditioned theory. We build the baseline calibration grid at b=0.04countspixel1b = 0.04\,\mathrm{counts\,pixel^{-1}}. The uncertainty budget below includes transfer to b=0.02b=0.02 and b=0.08countspixel1b=0.08\,\mathrm{counts\,pixel^{-1}}.

我们从阈值带样本中估计每个探测器位置的残差 R̂eml\widehat{R}_\mathrm{eml}。插值坐标把离轴半径与四象限方向标签结合起来。这个标签只用于插值。它不是物理探测器方位角,也不是通用 PSF 度量。我们检验过物理方位角,但没有采用它。它在稀疏插值网格上的覆盖较差。

We estimate the residual R̂eml\widehat{R}_\mathrm{eml} at each detector position from the threshold-band sample. The interpolation coordinate combines off-axis radius with a four-quadrant direction label. This label is used only for interpolation. It is not a physical detector azimuth or a general PSF measure. We tested physical azimuth but did not use it. It gave poorer coverage on the sparse interpolation grid.

Leave-one-position-out mean-crossing interpolation

配对的独立模拟采用与参考网格相同的 17 位置布局。由于当时输入文件无效,没有生成位置 P6 和 P10。我们还排除了 P3。它的离轴角为 6.3 角分,方位角为 180 度。在探测器边缘,它的拟合掩膜覆盖率只有约 0.55。这个不完整区域破坏了残差标定的常数背景假设。剩余网格包含 14 个位置。

The paired standalone simulation used the same 17-position layout as the reference grid. Positions P6 and P10 were not generated because their input files were invalid at that time. We also exclude P3. It lies at an off-axis angle of 6.3 arcmin and an azimuth of 180 degrees. At the detector edge, its fitting-mask coverage is only about 0.55. This incomplete area breaks the constant-background assumption of the residual calibration. The remaining grid has 14 positions.

验证依次留出每个位置。标定只使用其余位置。我们把预测的 SlimS_\mathrm{lim} 与留出位置的内部参考极限 SrefS_\mathrm{ref} 比较。

Validation leaves each position out in turn. The calibration uses only the remaining positions. We compare its predicted SlimS_\mathrm{lim} with the held-out position’s internal reference limit SrefS_\mathrm{ref}.

内部参考 SrefS_\mathrm{ref} 保持在拟合幅度坐标中。在每个留出位置,我们用其阈值带数据行测量 RemlR_\mathrm{eml}。然后,我们在同一位置和背景下求解 μ3p(Sref)=ΔCthReml\mu_{3p}(S_\mathrm{ref})=\Delta C_\mathrm{th}-R_\mathrm{eml}。预测值求解同一个方程,但残差由其他位置插值得到。因此,两个量都使用拟合幅度坐标。留出残差不进入插值模型。

The internal reference SrefS_\mathrm{ref} stays in the fitted-amplitude coordinate. At each held-out position, we measure RemlR_\mathrm{eml} from its threshold-band rows. We then solve μ3p(Sref)=ΔCthReml\mu_{3p}(S_\mathrm{ref})=\Delta C_\mathrm{th}-R_\mathrm{eml} at the same position and background. The prediction solves the same equation with the residual interpolated from the other positions. Thus both quantities use the fitted-amplitude coordinate. The held-out residual does not enter the interpolation model.

该检验测量流水线内部阈值图的插值。它不是相对于观测或注入恢复率的绝对检验。这样的检验需要在有代表性的位置进行密集的假源注入。我们按下式报告误差。

This test measures interpolation of the pipeline’s internal threshold map. It is not an absolute test against observations or injection-recovery fractions. Such a test requires dense fake-source injections at representative positions. We report the error as

|Slim,predSref|/Sref|S_{\mathrm{lim,pred}} - S_{\mathrm{ref}}| / S_{\mathrm{ref}}

[tab:unified-validation] 总结这一条件插值检验。在 DET_ML=6\mathrm{DET\_ML}=6 时,优先采用的二维插值的中位误差为 4.1%。在其他标定点覆盖的区域内,其最大误差为 11.0%。该区域包含 14 个留出位置中的 10 个。最近位置分配覆盖全部 14 个位置。其最大误差为 17.2%。背景从 b=0.04countspixel1b=0.04\,\mathrm{counts\,pixel^{-1}} 转移到 b=0.02b=0.020.08countspixel10.08\,\mathrm{counts\,pixel^{-1}},给 SlimS_\mathrm{lim} 增加的误差在 DET_ML=6\mathrm{DET\_ML}=6 时最多为 5.7%。两个误差在更高阈值下都会减小。

Table [tab:unified-validation] summarizes this conditional interpolation test. At DET_ML=6\mathrm{DET\_ML}=6, the preferred 2D interpolation has a 4.1% median error. Its maximum is 11.0% within the region covered by the other calibration points. This region contains 10 of 14 held-out positions. Nearest-position assignment covers all 14 positions. Its maximum error is 17.2%. Background transfer from b=0.04countspixel1b=0.04\,\mathrm{counts\,pixel^{-1}} to b=0.02b=0.020.08countspixel10.08\,\mathrm{counts\,pixel^{-1}} adds at most 5.7% error in SlimS_\mathrm{lim} at DET_ML=6\mathrm{DET\_ML}=6. Both errors decrease at higher thresholds.

lccc Mean crossing: median error (inside region) & 4.1% & 3.1% & 2.6%
Mean crossing: maximum error (inside region) & 11.0% & 9.1% & 7.8%
Mean crossing: maximum error (all positions) & 17.2% & 12.7% & 10.1%
Background transfer max (b=0.02b=0.020.080.08) & 5.7% & 4.1% & 3.2%

未标定理论的最大 SlimS_\mathrm{lim} 误差在 DET_ML=6\mathrm{DET\_ML}=6 时为 19.9%,中位误差为 7.2%。因此,在这个最低阈值处,它只是一个临界可用的独立运行近似。在 DET_ML=6\mathrm{DET\_ML}=6 时,全局标量修正失败,最大误差为 21.6%。这证实残差依赖位置。在覆盖区域内,我们优先采用二维插值。对于 14 位置样本,最近位置分配是已检验的后备方法。这些百分比是相对于内部穿越的插值误差。它们不是完备度误差或绝对灵敏度误差。

The uncalibrated theory has a maximum SlimS_\mathrm{lim} error of 19.9% at DET_ML=6\mathrm{DET\_ML}=6 (7.2% median). It is therefore only a borderline standalone approximation at this lowest threshold. A global scalar correction fails at DET_ML=6\mathrm{DET\_ML}=6 (maximum error 21.6%). This confirms that the residual depends on position. We prefer the 2D interpolation inside its covered region. Nearest-position assignment is the tested fallback for the 14-position sample. These percentages are interpolation errors relative to an internal crossing. They are not completeness or absolute sensitivity errors.

M1/M2 cross-configuration transfer test

转移样本包含 M1 第 4 波段(2.0–4.5 keV)、M2 第 1 波段(0.2–0.5 keV)和 M2 第 4 波段(2.0–4.5 keV)的独立运行模拟。样本在理论 DET_ML=6\mathrm{DET\_ML}=6–10 附近包含 529,107 行,分布于 1,672 个拟合可观测量单元。我们不做任何改变,直接应用 PN 第 4 波段参考 FFGG 系数。

The transfer sample contains standalone simulations for M1 band 4 (2.0–4.5 keV) and M2 band 1 (0.2–0.5 keV). It also includes M2 band 4 (2.0–4.5 keV). The sample has 529,107 rows in 1,672 fitted-observable cells near the theoretical DET_ML=6\mathrm{DET\_ML}=6--10 range. We apply the PN band 4 reference FF and GG coefficients without change.

均值 RMSE 测量以 ΔC\Delta C 为单位的单元均值残差。宽度比 RMSE 测量 σobs/V3p\sigma_\mathrm{obs}/\sqrt{V_{3p}} 的误差。不做改变地应用 PN 第 4 波段系数,会使位置误差增大而宽度比误差减小。因此,联合转移失败。这个结果不否定位置–宽度模型。M1/M2 计算完成后,将报告带重采样误差的定量检验。

The mean RMSE measures the cell mean residual in ΔC\Delta C units. The width-ratio RMSE measures errors in σobs/V3p\sigma_\mathrm{obs}/\sqrt{V_{3p}}. Applying the PN band 4 coefficients without change made the location error larger and the width-ratio error smaller. The joint transfer therefore fails. This result does not reject the location–scale model. A quantitative test with resampling errors will be reported when the M1/M2 campaign is complete.

Threshold-Crossing and Population-Inference Consequences

应用 I 解释传统的阈值选择目录。应用 II 定义百分位穿越及其目录空间有效面积。第 7 节说明真流量总体推断的限制。

Application I interprets a traditional threshold-selected catalog. Application II defines percentile crossings and their catalog-space effective area. Section 7 states the limit for true-flux population inference.

The forward kernel in ΔC\Delta C space

对于每个探测器位置,我们先把操作上的 DET_ML\mathrm{DET\_ML} 阈值转换为单图像三参数 ΔC\Delta C 值。例如,在 ν=3\nu=3 约定下,DET_ML=6\mathrm{DET\_ML}=6 对应 ΔCth=14.3\Delta C_\mathrm{th}=14.3。然后,我们在 ΔC\Delta C 空间中进行分布计算。统计量 DET_ML\mathrm{DET\_ML} 只用作最终的操作阈值标度。

For each detector position, we first convert the operational DET_ML\mathrm{DET\_ML} threshold to its single-image three-parameter ΔC\Delta C value. For example, DET_ML=6\mathrm{DET\_ML}=6 corresponds to ΔCth=14.3\Delta C_\mathrm{th}=14.3 under the ν=3\nu=3 convention. We then perform the distribution calculation in ΔC\Delta C space. The statistic DET_ML\mathrm{DET\_ML} is used only as the final operational threshold scale.

索引 kk 表示已经标定的拟合器和仪器配置。对于这样的配置,定义如下。

The index kk names the calibrated fitter and instrumental configuration. For such a configuration, define

ΔCmean(k)(S,x,b)=μ3p(S,b,𝒫x,x)+V3p(S,b,𝒫x,x)Fk(μ3p),σC(k)(S,x,b)=V3p(S,b,𝒫x,x)Gk(μ3p).\begin{aligned} \Delta C_\mathrm{mean}^{(k)}(S,x,b) &=\mu_{3p}(S,b,\mathcal{P}_x,\mathcal{M}_x) +\sqrt{V_{3p}(S,b,\mathcal{P}_x,\mathcal{M}_x)}\, F_k(\mu_{3p}), \label{eq:mean-threshold-curve} \\ \sigma_C^{(k)}(S,x,b) &=\sqrt{V_{3p}(S,b,\mathcal{P}_x,\mathcal{M}_x)}\, G_k(\mu_{3p}). \label{eq:width-threshold-curve} \end{aligned}

这里,SS 是拟合幅度,xx 是探测器位置。其他符号采用第 2 节中的定义。在高斯残差近似下,局部核为

Here SS is fitted amplitude, and xx is detector position. The other symbols follow the definitions in Section 2. With the Gaussian residual approximation, the local kernel is

p(ΔCS,x,b)𝒩[ΔCmean(k)(S,x,b),{σC(k)(S,x,b)}2],p(\Delta C\mid S,x,b) \simeq \mathcal{N}\!\left[ \Delta C_\mathrm{mean}^{(k)}(S,x,b),\, \{\sigma_C^{(k)}(S,x,b)\}^2 \right], \label{eq:deltac-forward-kernel}

相应的第 pp 百分位曲线为

and the corresponding ppth percentile curve is

ΔCp(S,x,b)ΔCmean(k)(S,x,b)+zpσC(k)(S,x,b),\Delta C_{p}(S,x,b) \simeq \Delta C_\mathrm{mean}^{(k)}(S,x,b) +z_p\,\sigma_C^{(k)}(S,x,b), \label{eq:deltac-percentile-curve}

这里,zpz_p 是标准正态分布的分位数,即百分位值。百分位计算同时需要经过标定的均值残差和 ΔC\Delta C 空间中的阈值带散布模型 σC\sigma_C。匹配 PN 第 4 波段核的六个百分位检验见第 4.5 节。

Here zpz_p is the standard-normal quantile, or percentile value. The percentile calculation needs both a calibrated mean residual and a threshold-band scatter model σC\sigma_C in ΔC\Delta C space. The six percentile checks for the matched PN band 4 kernel are given in Section 4.5.

Application I: interpreting traditional DET_ML\mathrm{DET\_ML}-selected catalogs

源按观测到的探测统计量选择,例如 DET_ML>T\mathrm{DET\_ML}>T。这等价于 ΔC>ΔCth\Delta C>\Delta C_\mathrm{th}。我们通过式([eq:deltac-forward-kernel])中的前向核解释这个目录阈值。

A source is selected by an observed detection statistic, such as DET_ML>T\mathrm{DET\_ML}>T. This is equivalent to ΔC>ΔCth\Delta C>\Delta C_\mathrm{th}. We interpret this catalog threshold through the forward kernel in Equation ([eq:deltac-forward-kernel]).

对于测得 ΔCobs\Delta C_\mathrm{obs} 的一个源,目录空间中的拟合幅度后验分布为

For a source with measured ΔCobs\Delta C_\mathrm{obs}, the fitted-amplitude posterior distribution in catalog space is

p(SΔCobs,x,b)p(ΔCobsS,x,b)π(S),p(S\mid \Delta C_\mathrm{obs},x,b) \propto p(\Delta C_\mathrm{obs}\mid S,x,b)\,\pi(S), \label{eq:posterior-single-source}

后验是在使用测量统计量后得到的分布。这里,π(S)\pi(S) 是拟合幅度坐标中的源计数先验。先验描述使用测量统计量之前预期的源分布。对于阈值选择样本,相应的表达式为

The posterior is the distribution after using the measured statistic. Here π(S)\pi(S) is a source-count prior in the fitted-amplitude coordinate. A prior states the expected source distribution before using the measured statistic. For a threshold-selected sample, the corresponding expression is

p(SΔC>ΔCth,x,b)P(ΔC>ΔCthS,x,b)π(S),p(S\mid \Delta C>\Delta C_\mathrm{th},x,b) \propto P(\Delta C>\Delta C_\mathrm{th}\mid S,x,b)\,\pi(S), \label{eq:posterior-threshold-selected}

其中

with

P(ΔC>ΔCthS,x,b)=ΔCthp(ΔCS,x,b)dΔC.P(\Delta C>\Delta C_\mathrm{th}\mid S,x,b) = \int_{\Delta C_\mathrm{th}}^\infty p(\Delta C\mid S,x,b)\,d\Delta C . \label{eq:threshold-passing-probability}

在高斯残差近似下,这一过阈概率是正态分布在阈值以上的面积。我们在 ΔC\Delta C 空间中计算它。上面的两种反演计算需要先验 π(S)\pi(S)。下面的有效面积计算不需要先验。拟合幅度 SS 处的目录空间有效面积为

Under the Gaussian residual approximation, this passing probability is the area of a normal distribution above the threshold. We evaluate it in ΔC\Delta C space. The two inverse calculations above require the prior π(S)\pi(S). The effective-area calculation below does not require a prior. The catalog-space effective area at fitted amplitude SS is

Ωth(S)=jΩjP(ΔC>ΔCthS,xj,bj),\Omega_\mathrm{th}(S) = \sum_j \Omega_j\, P(\Delta C>\Delta C_\mathrm{th}\mid S,x_j,b_j), \label{eq:traditional-probabilistic-sky-coverage}

这里,jj 是天空或探测器像素的索引,Ωj\Omega_j 是一个像素的面积。这个有效面积按过阈概率加权。它不是基于单个极限幅度的阶跃函数。

Here jj indexes sky or detector pixels, and Ωj\Omega_j is the area of one pixel. This effective area is weighted by passing probability. It is not a step function based on one limiting amplitude.

Application II: fitted-amplitude percentile cuts

百分位图询问多大的拟合幅度能使指定比例的实现超过阈值。这是前向计算,不是对带噪声的 DET_ML\mathrm{DET\_ML} 选择样本进行反演。制图计算固定 SS,并计算 P(ΔC>ΔCthS,x,b)P(\Delta C>\Delta C_\mathrm{th}\mid S,x,b)。因此,它不需要 dN/dSdN/dS 斜率或源计数指数。

The percentile map asks what fitted amplitude lets a chosen fraction of realizations exceed the threshold. This is a forward calculation, not an inversion of a noisy DET_ML\mathrm{DET\_ML}-selected sample. The map calculation fixes SS and evaluates P(ΔC>ΔCthS,x,b)P(\Delta C>\Delta C_\mathrm{th}\mid S,x,b). It therefore needs no dN/dSdN/dS slope or source-count index.

通常的灵敏度图计算可由下列均值曲线穿越恢复。

The usual sensitivity-map calculation is recovered as the mean-curve crossing

ΔCmean(k)(S,x,b)=ΔCth.\Delta C_\mathrm{mean}^{(k)}(S,x,b)=\Delta C_\mathrm{th}. \label{eq:mean-curve-crossing}

百分位穿越通过求解下式得到。

Percentile crossings are obtained by solving

ΔCp(k)(S,x,b)=ΔCth,\Delta C_p^{(k)}(S,x,b)=\Delta C_\mathrm{th}, \label{eq:percentile-threshold-crossing}

其中 pp 是选定的百分位。第 4.5 节给出匹配 PN 第 4 波段配置的六个百分位检验。表 [tab:threshold-crossing-terms] 定义本文使用的术语。

for a chosen pp. Section 4.5 gives the six percentile checks for the matched PN band 4 configuration. Table [tab:threshold-crossing-terms] defines the terms used here.

lll Mean limit & ΔCmean(k)(S)=ΔCth\Delta C_\mathrm{mean}^{(k)}(S)=\Delta C_\mathrm{th} & Corrected fitted-amplitude mean crossing (Asimov when Fk=0F_k=0)
97.7% threshold crossing & ΔC2.3(k)(S)=ΔCth\Delta C_{2.3}^{(k)}(S)=\Delta C_\mathrm{th} & Nominally 97.7% expected to pass
90% threshold crossing & ΔC10(k)(S)=ΔCth\Delta C_{10}^{(k)}(S)=\Delta C_\mathrm{th} & Nominally 90% expected to pass
84% threshold crossing & ΔC16(k)(S)=ΔCth\Delta C_{16}^{(k)}(S)=\Delta C_\mathrm{th} & Nominally 84% expected to pass
50% threshold crossing & ΔC50(k)(S)=ΔCth\Delta C_{50}^{(k)}(S)=\Delta C_\mathrm{th} & Nominally 50% expected to pass
Injection 50% completeness & P(detectedStrue)=0.5P(\mathrm{detected}\mid S_\mathrm{true})=0.5 & Fake-source recovery

对每个探测器像素应用相同的穿越规则,可得到均值阈值图或已获支持的百分位阈值图。我们可以把每幅图转换为拟合幅度有效面积曲线。对于每个试验拟合幅度,我们统计局部极限幅度更低的像素。

Applying the same crossing rule to every detector pixel gives a mean-threshold map or a supported percentile-threshold map. We can turn each map into a fitted-amplitude effective-area curve. For each trial fitted amplitude, we count pixels whose local limiting amplitude is lower:

$$\Omega_{p,\rm fit}(S) = \sum_j \Omega_j\, I\!\left[S_\mathrm{lim}^{(p)}(j) \le S\right],$$

这里,jj 是天空或探测器像素的索引。符号 pp 表示式([eq:percentile-threshold-crossing]) 中的百分位曲线。这个目录空间量取决于局部背景、PSF、掩膜、阈值和残差标定。

Here jj indexes sky or detector pixels. The symbol pp names the percentile curve in Equation ([eq:percentile-threshold-crossing]). This catalog-space quantity depends on local background, PSF, mask, threshold, and residual calibration.

Scope and Limitations

表 [tab:evidence-tiers] 给出总结。位置和宽度的解析分离是一般结果。数值函数 FkF_kGkG_k 只属于一个有效 PSF、掩膜、搜索范围和拟合器。新的相机或能段会改变 PSF。新的流水线也可能改变其内部 PSF 像素网格和拟合状态。即使保存的注入模板保持不变,这种改变仍可能发生。因此,定量转移需要匹配标定。只有相机标签并不足够。

Table [tab:evidence-tiers] gives a summary. The analytic separation of location and scale is the general result. The numerical FkF_k and GkG_k functions belong to one effective PSF, mask, search range, and fitter. A new camera or energy band changes the PSF. A new pipeline can also change its internal PSF pixel grid and fitting state. This can happen even when the stored injection template stays fixed. Quantitative transfer therefore requires matched calibration. A camera label alone is not enough.

在该表中,μ3p\mu_{3p} 是精确的固定模型位置。V3pV_{3p} 的第一项是精确的固定模型方差。它的 Fisher 投影项是局部近似。函数 FkF_kGkG_k 是依赖配置的低计数修正。

In this table, μ3p\mu_{3p} is the exact fixed-model location. The first term of V3pV_{3p} is the exact fixed-model variance. Its Fisher projection term is a local approximation. The functions FkF_k and GkG_k are the configuration-specific low-count corrections.

lll Analytic μ3p,V3p\mu_{3p},V_{3p} & Exact fixed-model moments; local Fisher projection & Matched three-parameter fits in the validated likelihood regime
PN band 4 reference F,GF,G & Out-of-sample validated & Reference-fitter threshold probabilities in tested support
PN band 4 standalone mean grid & Leave-one-position-out case study & Internal mean-crossing interpolation only
M1/M2 standalone transfer & Joint transfer fails; resampling errors pending & Recalibrate Fk,GkF_k,G_k after the campaign
PN multiband standalone & Not tested here & No coefficient, width, or tail claim
Official 4XMM catalogs & Not validated here & No weak-source completeness or catalog correction

位置账目带来另一项限制。匹配参考验证使用 17 个位置。第 5.2 节说明为什么独立运行的结果覆盖 14 个位置。

Position accounting sets another limit. The matched reference validation uses 17 positions. Section 5.2 explains why the standalone results cover 14 positions.

匹配模拟在具有给定局部背景的单幅图像中拟合孤立点源。经过检验的推导不涵盖扩展源、拥挤场、多图像似然或合并观测。它也不包括背景估计的不确定性和其他拟合参数个数。我们在 PN 第 4 波段验证参考核。独立运行的均值网格只覆盖 b=0.02b=0.020.08countspixel10.08\,\mathrm{counts\,pixel^{-1}}。它的四象限方向标签不是物理 PSF 参数。在 M1/M2 实验中,位置和宽度误差不能同时改善。定量转移检验要等到计算完成。精确的内部 ELLBETA 拟合与搜索对象没有保存。因此,该检验不能确定转移所缺少的拟合器状态变量。

The matched simulations fit isolated point sources in single images with a specified local background. The tested derivation does not cover extended sources, crowded fields, multi-image likelihoods, or merged observations. It also excludes background-estimation uncertainty and other numbers of fitted parameters. We validate the reference kernel in PN band 4. The standalone mean grid covers only b=0.02b=0.020.08countspixel10.08\,\mathrm{counts\,pixel^{-1}}. Its four-quadrant direction label is not a physical PSF parameter. In the M1/M2 experiment, the location and width errors do not improve together. A quantitative transfer test awaits campaign completion. The exact internal ELLBETA fit and search object was not saved. The test therefore cannot identify the missing fitter-state variable needed for transfer.

任何目录选择样本都不能为弱源核提供核心证据。在目录阈值附近,完整的母体分布未知。只有按似然选择的目录不能测量缺失源的条件宽度。正式目录的选择还包括堆叠、源混淆、渐晕、变化的背景图和联合多波段判定。其他巡天流水线使用端到端模拟,把这些效应作为一个系统进行标定 (Brunner et al. 2022; Evans et al. 2024; Liu et al. 2022)

No catalog-selected sample provides core evidence for the weak-source kernel. Near a catalog threshold, the full parent distribution is unknown. A likelihood-selected catalog alone cannot measure the conditional width of missing sources. Official catalog selection also includes stacking, source confusion, vignetting, changing background maps, and joint multi-band decisions. Other survey pipelines use end-to-end simulations to calibrate these effects as one system (Brunner et al. 2022; Evans et al. 2024; Liu et al. 2022).

我们没有标定独立运行的宽度。它的百分位曲线需要新的整位置分布尾部检验。第 6 节中的有效面积是目录空间量。它们不是真流量选择函数。总体层面的 Eddington 修正需要源先验和联合模型 p(ΔC,ŜStrue,x,b)p(\Delta C,\widehat S\mid S_\mathrm{true},x,b)。其归一化还必须包含完整的目录选择事件。

We did not calibrate the standalone width. Its percentile curves require new whole-position tests of the distribution tails. The effective areas in Section 6 are catalog-space quantities. They are not a true-flux selection function. A population-level Eddington correction needs a source prior and the joint model p(ΔC,ŜStrue,x,b)p(\Delta C,\widehat S\mid S_\mathrm{true},x,b). It must also include the full catalog selection event in its normalization.

Conclusions

主要结果是条件宽度的主导 Fisher 近似。Fisher 投影去除被拟合吸收的幅度方向和两个位置方向。由此得到的 V3pV_{3p} 是直接公式。它只取决于拟合幅度、背景、像素化 PSF 和掩膜。它不含拟合系数。对应的 μ3p\mu_{3p} 表达式扩展了 Stewart (2009) 的只拟合幅度解析 Cash 灵敏度计算。更早的匹配滤波灵敏度工作见 Stewart (2006)。经验函数 FkF_kGkG_k 对解析位置和方差给出较小的低计数修正。它们不取代这些公式。下标 kk 表示拟合器和仪器配置。

The main result is the leading Fisher approximation to the conditional width: σΔC4[iMiμiln2(μi/bi)gTI1g].\sigma_{\Delta C} \simeq \sqrt{4\left[ \sum_i M_i\mu_i\ln^2(\mu_i/b_i)-g^TI^{-1}g \right]}. The Fisher projection removes the amplitude and two position directions absorbed by the fit. The resulting V3pV_{3p} is a direct formula. It depends only on fitted amplitude, background, pixelized PSF, and mask. It has no fitted coefficient. The companion μ3p\mu_{3p} expression extends the amplitude-only analytic Cash-sensitivity calculation of Stewart (2009). Earlier matched-filter sensitivity work is given by Stewart (2006). The empirical FkF_k and GkG_k functions give small low-count corrections to the analytic location and variance. They do not replace these formulas. Their subscript kk identifies the fitter and instrumental configuration.

匹配的 PN 第 4 波段参考拟合器有 266,837 次高信号拟合。其标准化残差均值为 0.068±0.0020.068\pm 0.002,宽度为 0.977±0.0010.977\pm 0.001。对应的位置重采样误差分别为 ±0.006\pm 0.006±0.002\pm 0.002。在低信号下,经验位置–宽度核采用所示高斯形式。函数用 μ3p3\mu_{3p}\geq 3 的 749,863 行数据拟合。残差形状评估保留全部 810,987 次干净拟合。在 realization block 验证中,平均通过率误差采用 DET_ML=6\mathrm{DET\_ML}=6、8 和 10。它从原始 Fisher 理论的 0.01359±0.000100.01359\pm 0.00010 降至同时加入两项修正后的 0.00199±0.000080.00199\pm 0.00008。经验分箱基准为 0.00196±0.000080.00196\pm 0.00008。宽度改进小于位置改进。按实现重采样时,其配对降低量为 0.00044±0.000050.00044\pm 0.00005;按位置重采样时为 ±0.00007\pm 0.00007。两项增益都超过六个标准误。一项分组检验还否定了用只依赖 FF 的函数替代 GG。均值使残差居中,并去除单元内梯度。它不决定条件宽度。

The matched PN band 4 reference fitter has 266,837 high-signal fits. Their standardized residual mean is 0.068±0.0020.068\pm0.002, and their width is 0.977±0.0010.977\pm0.001. The position-resampling errors are ±0.006\pm0.006 and ±0.002\pm0.002, respectively. At low signal, the empirical location–scale kernel is ΔC𝒩[μ3p+V3pF(μ3p),V3pG2(μ3p)]\Delta C\simeq \mathcal{N}\!\left[ \mu_{3p}+\sqrt{V_{3p}}F(\mu_{3p}), V_{3p}G^2(\mu_{3p}) \right] The functions are fitted on 749,863 rows with μ3p3\mu_{3p}\geq3. The residual-shape evaluation retains all 810,987 clean fits. In realization-block validation, the mean passing-fraction error uses DET_ML=6\mathrm{DET\_ML}=6, 8, and 10. It decreases from 0.01359±0.000100.01359\pm0.00010 for raw Fisher theory to 0.00199±0.000080.00199\pm0.00008 after both corrections. The empirical-bin benchmark is 0.00196±0.000080.00196\pm0.00008. The width improvement is smaller than the location improvement. Its paired decrease is 0.00044±0.000050.00044\pm0.00005 under realization resampling (±0.00007\pm0.00007 by position). Both gains exceed six standard errors. A grouped test also rejects replacing GG with a function of FF alone. The mean centers the residual and removes cell gradients. It does not determine the conditional width.

独立运行的 emldetect 仍可作为流水线专属层使用。PN 第 4 波段实验测量内部均值穿越的插值。在 DET_ML=6\mathrm{DET\_ML}=6 时,其最大误差在覆盖区域内为 11.0%,在全部位置上为 17.2%。这些不是完备度误差。它的宽度尚未标定。M1/M2 检验给出第二项限制。不做改变的 PN 系数会增大位置误差,但减小宽度比误差。因此,联合转移失败。带重采样误差的定量检验要等到计算完成。可以复用的结果是解析位置–宽度结构,而不是通用系数表。

Standalone emldetect remains useful as a pipeline-specific layer. The PN band 4 experiment measures interpolation of an internal mean crossing. At DET_ML=6\mathrm{DET\_ML}=6, its maximum errors are 11.0% inside the covered region and 17.2% across all positions. These are not completeness errors. Its width is not calibrated. The M1/M2 test gives a second limit. Unchanged PN coefficients increase the location error but decrease the width-ratio error. The joint transfer therefore fails. A quantitative test with resampling errors awaits campaign completion. The reusable result is the analytic location–scale structure, not a universal coefficient table.

经过标定的匹配核定义拟合幅度穿越概率和有效面积。其百分位标定见第 4.5 节。这些限制把经验系数限定在测量它们时所用的 PSF、搜索和拟合器配置中。

The calibrated matched kernel defines fitted-amplitude crossing probabilities and effective area. Its percentile calibration is given in Section 4.5. These limits tie the empirical coefficients to the PSF, search, and fitter configuration in which they were measured.

Data and Code Availability

标定网格和交叉验证表将在论文发表时存入持久档案。存档还将包括绘图脚本、SAS 配置文件和最小复现脚本。这些脚本将记录命令、随机种子、PSF 参数和 emldetect 标志。DOI 和许可证将在投稿前加入。在审稿期间,机器可读的标定表和绘图代码保留在项目产物中。

The calibration grid and cross-validation tables will be deposited in a persistent archive upon publication. The deposit will also include figure scripts, SAS configuration files, and minimal reproduction scripts. These scripts will record commands, random seeds, PSF parameters, and emldetect flags. The DOI and license will be inserted before submission. During review, machine-readable calibration tables and figure code remain with the project artifacts.

Author Contributions

R.H. 建立了统计模型、模拟和分析代码,并撰写初稿。草稿说明:所有作者批准投稿版本后,将使用 CRediT 分类补全共同作者的贡献。

R.H. developed the statistical model, simulations, analysis code, and initial manuscript. Draft note: coauthor roles will be completed using the CRediT taxonomy after all authors approve the submission version.

Competing Interests

草稿说明:所有作者将在投稿前确认利益冲突声明。

Draft note: the competing-interest declaration will be confirmed by all authors before submission.

Funding

本工作感谢国家自然科学基金的支持。草稿说明:作者确认后将加入项目编号。

This work acknowledges support from the National Natural Science Foundation of China. Draft note: grant identifiers will be added after author confirmation.

Ethics Statement

本研究使用数值模拟和档案标定产品。它不涉及人类参与者、动物或可识别个人身份的数据。

This study uses numerical simulations and archival calibration products. It involves no human participants, animals, or personally identifiable data.

AI-Assistance Disclosure

草稿说明:投稿前将按照所选期刊的政策确定最终声明。

Draft note: a disclosure consistent with the policy of the selected journal will be finalized before submission.

Diagnostic role of injected source strength

图 1 给出结果。模拟知道注入幅度 StrueS_\mathrm{true}。不过,理论和匹配标定以拟合幅度 Ŝ\widehat{S} 为条件。固定拟合的 Ŝ\widehat{S} 后,不同 StrueS_\mathrm{true} 组的残差分布高度重合。最低 Ŝ\widehat{S} 分箱中的偏移是第 4.2 节所述的低信号、超出 Fisher 近似的偏差。它不是应以 StrueS_\mathrm{true} 为条件的证据。

Figure 1 shows the result. The simulations know the injected source strength StrueS_\mathrm{true}. However, the theory and matched calibration condition on fitted amplitude Ŝ\widehat{S}. At fixed fitted Ŝ\widehat{S}, residual distributions from different StrueS_\mathrm{true} groups overlap closely. The offset in the lowest Ŝ\widehat{S} bin is the low-signal beyond-Fisher bias from Section 4.2. It is not evidence for conditioning on StrueS_\mathrm{true}.

Check that injected source strength StrueS_\mathrm{true} is a simulation label, not the theory’s conditioning variable. Each panel fixes a fitted-amplitude range Ŝ\widehat{S} at b=0.04countspixel1b=0.04\,\mathrm{counts\,pixel^{-1}}. It plots the standardized ΔC\Delta C residual Z=(ΔCμ3p)/V3pZ=(\Delta C-\mu_{3p})/\sqrt{V_{3p}} for groups of injected StrueS_\mathrm{true}. The StrueS_\mathrm{true} groups largely overlap once Ŝ\widehat{S} is fixed. The lowest Ŝ\widehat{S} bins show the known positive beyond-Fisher shift. Higher-Ŝ\widehat{S} bins approach the expected N(0,1)N(0,1) behavior. This figure checks observable conditioning. It is not a separate validation of an StrueS_\mathrm{true}-conditioned theory.

Acknowledgments

本研究使用了 XMM-Newton 卫星获得的数据。XMM-Newton 是 ESA 的科学任务,其仪器和相关贡献由 ESA 成员国及 NASA 直接资助。

This research has made use of data obtained from the XMM-Newton satellite, an ESA science mission with instruments and contributions directly funded by ESA Member States and NASA.

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