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

THOR is a radiation transport code for unstructured meshes.

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

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++

Fortran95 code submissions for solving Physics problems numerically.

C/Fortran OpenMP Parallel N-Body Simulation

Massively Parallel Semiconductor Device Simulation using Quantum Monte-Carlo

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

Machine learning generation of Slater Determinants in the Configuration Interaction problem

CDFT Development Branch for CP2K

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

Undergraduate project to simulate ferromagnetic properties with a Monte-Carlo method.

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