Solution of Hartree-Fock equations within Pople's STO-3G basis set

Full-potential Linearized Augmented Plane Wave code FLEUR: All-electron DFT (repo mirror)

THOR is a radiation transport code for unstructured meshes.

many-body perturbation theory without empty states

Implementation of SIS epidemic model for large and heterogeneous networks using Fortran.

an Open-Source Code for Nanoplasmonics

Richmol is for variational simulations of molecular nuclear motion dynamics in fields

Fortran Numerical Methods is an open-source project that provides efficient and well-organized implementations of various numerical methods in the Fortran programming language. It includes solutions for ordinary differential equations, numerical interpolation, and root-finding of equations, among others.

Thermodynamics and phase stability of multicomponent alloys using conventional and enhanced sampling techniques applied to the Bragg–Williams Hamiltonian

Implementation of the vc-sqnm and sqnm optimization algorithms in C++

C/Fortran OpenMP Parallel N-Body Simulation

Fortran95 code submissions for solving Physics problems numerically.

Massively Parallel Semiconductor Device Simulation using Quantum Monte-Carlo

Machine learning generation of Slater Determinants in the Configuration Interaction problem

CDFT Development Branch for CP2K

My work on the PyNFAM (Python wrapper for proton-neutron finite amplitude method) code for use in beta decay calculations

A neutron transport mini-app with both diamond-difference and linear-discontinuous finite element spatial discretisation options

This is the repo of the Computational physics program using to solve the problem in physcis and do physics simulation