Computational physics bridges the gap between abstract theory and real-world observation by using powerful computers to solve complex physical problems. This field allows scientists to simulate everything from the collision of subatomic particles to the swirling dynamics of galaxies, offering insights that traditional experiments alone cannot provide.

On Gist.Science, we continuously process every new preprint in this category from arXiv to make these breakthroughs accessible to everyone. Each entry is accompanied by both a clear, plain-language explanation and a detailed technical summary, ensuring that researchers and curious readers alike can grasp the significance of the latest findings without getting lost in dense equations.

Below are the latest papers in computational physics, curated to keep you at the forefront of this rapidly evolving discipline.

Utilising a learned forward operator in the inverse problem of photoacoustic tomography

This paper demonstrates that a Fourier neural operator can serve as an accurate and computationally efficient learned forward operator for solving the inverse problem in photoacoustic tomography via gradient-based optimization, outperforming conventional pseudospectral kk-space methods in efficiency while maintaining high accuracy.

Karoliina Puronhaara, Teemu Sahlström, Andreas Hauptmann, Tanja Tarvainen2026-03-24🔬 physics

Wakefield amplification via coherent Resonant excitation with two copropagating laser pulses in homogeneous plasma

This study demonstrates that coherent resonant excitation using two copropagating laser pulses with a specific temporal separation of approximately a quarter plasma wavelength can amplify wakefield amplitudes up to three times greater than those generated by a single pulse in homogeneous plasma.

Abhishek Kumar Maurya, Dinkar Mishra, Bhupesh Kumar, Ramesh C Sharma, Lal C Mangal, Binoy K Das, Brijesh Kumar2026-03-24🔬 physics

A Unified Heterogeneous Implementation of Numerical Atomic Orbitals-Based Real-Time TDDFT within the ABACUS Package

This paper presents a unified heterogeneous computing framework within the ABACUS package that accelerates real-time time-dependent density functional theory simulations based on numerical atomic orbitals through co-designed abstraction layers, demonstrating significant speedups on single GPUs and high parallel efficiency across multiple GPUs for large-scale electron dynamics studies.

Taoni Bao, Yuanbo Li, Zichao Deng, Haotian Zhao, Denghui Lu, Yike Huang, Chao Lian, Lixin He, Mohan Chen2026-03-24🔬 cond-mat.mtrl-sci

A Novel Method for Enforcing Exactly Dirichlet, Neumann and Robin Conditions on Curved Domain Boundaries for Physics Informed Machine Learning

This paper presents a systematic method combining exact domain mappings, Theory of Functional Connections (TFC), and transfinite interpolations to enforce Dirichlet, Neumann, and Robin boundary conditions with machine-precision accuracy on general quadrilateral domains with curved boundaries, while rigorously addressing compatibility constraints at boundary intersections.

Suchuan Dong, Yuchuan Zhang2026-03-24🔬 physics

Stable, Fast, and Accurate Kohn-Sham Inversion in Gaussian Basis for Open Shell Molecular and Condensed Phase Systems via Density Matrix Penalization

This paper presents a robust and efficient density matrix-based Kohn-Sham inversion method formulated entirely within a Gaussian basis that utilizes Lowdin orthogonalization and analytical penalty potentials to overcome the limitations of conventional approaches, achieving superior accuracy in reproducing target electron densities for both open-shell molecular and condensed phase systems.

Ziwei Chai, Sandra Luber2026-03-24🔬 physics