Pinned Repositories
adaptive-finite-differencing
Input and output files/data for AFD
NEGF-User-Interface
rmgdft
RMG is an Open Source code for electronic structure calculations and modeling of materials and molecules. It is based on density functional theory and uses a real space basis and pseudopotentials.
rmgwebinterface
RMG web based input file generator. Click the following link to try. https://share.streamlit.io/rmgdft/rmgwebinterface/main/main.py
rmgwebpostprocess
Web interface to plot electonic density of states, charge density, etc. https://share.streamlit.io/rmgdft/rmgwebpostprocess/main.py
noncollinear
Polymer
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.
RMG-plot
RMG-WebUI
WenchangLu's Repositories
WenchangLu/noncollinear
WenchangLu/Polymer
WenchangLu/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.
WenchangLu/RMG-plot
WenchangLu/RMG-WebUI