Files
beta_shape_pnpi/docs/04-screening-correction.md
T

94 lines
3.9 KiB
Markdown
Raw Blame History

This file contains ambiguous Unicode characters
This file contains Unicode characters that might be confused with other characters. If you think that this is intentional, you can safely ignore this warning. Use the Escape button to reveal them.
---
title: "04 – Screening Correction"
date: 2026-04-26
tags:
- beta-spectrum/correction/screening
status: active
aliases: [Atomic Screening, S(Z,W)]
cssclasses: []
related_components: [[12-atomic-overlap]], [[13-chemical-effects]]
---
# Atomic Electron Screening Correction $S(Z,W)$
## Physical Origin
The Fermi function ([[01-fermi-function]]) assumes the β particle moves in the Coulomb field of a bare nucleus. In reality, atomic electrons partially screen this charge at large distances from the nucleus, modifying the effective potential experienced by the emitted electron/positron. This is particularly important at low kinetic energies where the β particle spends more time far from the nucleus.
## The Screening Correction
Screening is implemented as a ratio method:
$$S(Z,W) = \frac{F_{\text{screened}}(Z, W)}{F_0(Z, W - V_0/m_ec^2)} \tag{144}$$
where $V_0$ is the screening potential (binding energy of the outermost atomic electrons). The denominator evaluates the Fermi function at a shifted energy representing the unscreened case.
### Screening Potential
The screening potential $V_0$ depends on:
- Atomic number $Z$ (parent atom)
- Chemical/physical state (neutral atom, ionized molecule)
- Electronic configuration
For neutral atoms, $V_0$ is typically a few eV to tens of eV — small compared to nuclear potentials but significant at β energies below ~10 keV.
### Molecular Screening Correction
In molecular environments, the screening potential changes:
$$\Delta S_{\text{Mol}} \quad (\text{Eq. 176})$$
Since screening is typically at sub-percent level maximum, molecular deviations are expected at the **few $10^{-4}$** level — relevant for precision work down to 1 keV.
## Energy Dependence
- **Dominant at low energies** (T < ~50 keV): where the β particle's wave function is most affected by atomic electron cloud
- **Negligible at high energies**: $S(Z,W) \to 1$ as $W \gg V_0$
- The effect reverses sign between β⁻ and β⁺ (electrons attracted to/repelled from electron cloud differently)
## Shake-Up Effects on Screening
Atomic excitations during β decay modify screening:
> [!warning] Tritium case
> In tritium β⁻ decay, the screening potential can change by as much as **20%** because only a single electron contributes to atomic Coulomb interaction. For heavier systems, relative changes decrease but scale with $Z$. Neglecting shake-up introduces errors of order $\sim 1 \times 10^{-4}$.
Shake-off (continuum ejection) has smaller effect:
- With $\Delta Z_{\text{eff}} \approx 0.3$–$0.4$, yields ~**0.1%** relative change in screening potential → few $10^{-5}$ level in spectral shape
- **Negligible at target precision** for most nuclei
## Calculator Implementation
> [!tip] Code mapping
> Module: `beta_spectrum/components/screening.py` → `ScreeningCorrection(FermiFunction)` class
>
> Uses ratio method with smooth logistic switching function. The screening potential $V_0$ is passed as a parameter and depends on the parent atom's atomic number.
### API Usage
```python
from beta_spectrum import ScreeningCorrection, FermiFunction
screen = ScreeningCorrection(
FermiFunction(Z_parent=90), # bare nucleus reference
V0=0.015 # screening potential in m_e units (~7.6 keV)
)
values = screen(W_grid)
```
## Size Comparison with Other Corrections
From Hayen et al. Table (Section VIII overview):
| Correction | Magnitude | Energy Range Most Relevant |
|---|---|---|
| Screening $S$ | $10^{-3}$ – $10^{-4}$ | T < 50 keV |
| Exchange $X$ | up to ~20% at lowest E | T < 10 keV |
| Molecular screening $\Delta S_{\text{Mol}}$ | few $10^{-4}$ | T < 5 keV (molecular) |
## Related Notes
- [[12-atomic-overlap]] — Atomic mismatch / overlap correction $r(Z,W)$, Bahcall correction
- [[13-chemical-effects]] — Molecular environment influence on screening and exchange
- [[05-exchange-correction]] — Electron exchange with atomic orbitals (often combined with screening)