Pinned Repositories
moldyn
Python Implementation of Molecular Dynamics using Lennard-Jones Potential
pseudopotentiallibrary
Repository for PseudopotentialLibrary.org website and database
qmcpack
Main repository for QMCPACK, an open-source production level many-body ab initio Quantum Monte Carlo code for computing the electronic structure of atoms, molecules, and solids.
heavy_element_ecps
pseudopotentiallibrary
Repository for PseudopotentialLibrary.org website and database
qmcpack
Main repository for QMCPACK, an open-source production level many-body ab initio Quantum Monte Carlo code for computing the electronic structure of atoms, molecules, and solids with full performance portable GPU support
qmcpack_workshop_2023
QMCPACK Users Workshop 2023
aannabe's Repositories
aannabe/moldyn
Python Implementation of Molecular Dynamics using Lennard-Jones Potential
aannabe/pseudopotentiallibrary
Repository for PseudopotentialLibrary.org website and database
aannabe/qmcpack
Main repository for QMCPACK, an open-source production level many-body ab initio Quantum Monte Carlo code for computing the electronic structure of atoms, molecules, and solids.