Differentiable emulation for high-dimensional Bayesian calibration of nuclear reaction models

Full Bayesian calibration of expensive nuclear models has been blocked not by the cost of any single solve, but by the absence of exact likelihood gradients in legacy parameter-dependent operators, which forces gradient-free samplers to spend $\mathcal{O}(10^5)$ evaluations exploring high-dimensional correlated posteriors. I introduce DREAM, a differentiable calibration strategy in which the parameter-dependent operator is sampled offline by any legacy code, compressed by singular value decomposition, and reconstructed online in a differentiable framework so that automatic differentiation delivers exact likelihood gradients through the full forward solve at the cost of one additional evaluation per Hamiltonian Monte Carlo step. The construction is operator-level and depends only on smooth, compressible parameter dependence; the underlying physics solver is treated as a black box. As a representative demonstration, DREAM is applied to a continuum-discretized coupled-channels (CDCC) analysis of $d$+$^{58}$Ni elastic scattering at $20$~MeV with eighteen optical-potential parameters, for which No-U-Turn Sampling converges on a single GPU in under ten minutes from a cold start with zero divergent transitions, yielding a full Bayesian posterior for a breakup reaction. The mean emulator error is more than an order of magnitude below the inferred model discrepancy, so the posterior is set by the reaction model rather than the surrogate. Treating the Koning-Delaroche systematics as an informative prior, the data update the well-determined parameter combinations, raising the mean deuteron surface absorption about $36\%$ above the Koning-Delaroche value, while the under-determined directions remain at the prior; this is a representative payoff that the multi-energy datasets DREAM is designed to accommodate can sharpen into a full physics interpretation.

Authors

Publication Details

Journal
Physical Review C
Published
2026-11-04
DOI
https://doi.org/10.1103/9szm-dgtr
Primary Topic
Markov Chains and Monte Carlo Methods
Type
article
Field-Weighted Citation Impact
0.00
Controls
|||
ALL TIME
JAN
FEB
MAR
APR
MAY
JUN
JUL
AUG
SEP
OCT
article

Differentiable emulation for high-dimensional Bayesian calibration of nuclear reaction models

Jin Lei
1 links
Physical Review C
Markov Chains and Monte Carlo Methods
article

Differentiable emulation for high-dimensional Bayesian calibration of nuclear reaction models

Jin Lei
article en

Abstract

Full Bayesian calibration of expensive nuclear models has been blocked not by the cost of any single solve, but by the absence of exact likelihood gradients in legacy parameter-dependent operators, which forces gradient-free samplers to spend $\mathcal{O}(10^5)$ evaluations exploring high-dimensional correlated posteriors. I introduce DREAM, a differentiable calibration strategy in which the parameter-dependent operator is sampled offline by any legacy code, compressed by singular value decomposition, and reconstructed online in a differentiable framework so that automatic differentiation delivers exact likelihood gradients through the full forward solve at the cost of one additional evaluation per Hamiltonian Monte Carlo step. The construction is operator-level and depends only on smooth, compressible parameter dependence; the underlying physics solver is treated as a black box. As a representative demonstration, DREAM is applied to a continuum-discretized coupled-channels (CDCC) analysis of $d$+$^{58}$Ni elastic scattering at $20$~MeV with eighteen optical-potential parameters, for which No-U-Turn Sampling converges on a single GPU in under ten minutes from a cold start with zero divergent transitions, yielding a full Bayesian posterior for a breakup reaction. The mean emulator error is more than an order of magnitude below the inferred model discrepancy, so the posterior is set by the reaction model rather than the surrogate. Treating the Koning-Delaroche systematics as an informative prior, the data update the well-determined parameter combinations, raising the mean deuteron surface absorption about $36\%$ above the Koning-Delaroche value, while the under-determined directions remain at the prior; this is a representative payoff that the multi-energy datasets DREAM is designed to accommodate can sharpen into a full physics interpretation.

Physical Review C
Openalex Percentile: Top 64%
Markov Chains and Monte Carlo Methods
AI Navigator

Ask Laika to Summarize, Analyze, and Connect papers live on the map.

Summarize Papers & Methodologies

Extract key findings, datasets, and comparative methods across publications.

Benchmark Rankings & Visual Analytics

Rank top research institutions, authors, funders, topics, and journals by Field-Weighted Citation Impact (FWCI) and paper volume with instant charts.

Connect Distant Disciplines

Bridge topological clusters on the map to find hidden collaborative intersections.

Laika access coming soon