Xubo Wang's repositories
bagel
Brilliantly Advanced General Electronic-structure Library
Language:C++GPL-3.0000
CDFCI
C++ implemented Coordinate Descent Full Configuration Interaction (CDFCI) package for quantum chemistry calculation.
Language:C++BSD-3-Clause000
Language:C++NOASSERTION000
madness
Multiresolution Adaptive Numerical Environment for Scientific Simulation
Language:C++GPL-2.0000
Language:C++000
pyscf
Python module for quantum chemistry
Language:PythonApache-2.0000
pyscf-doc
pyscf-doc
Language:PythonApache-2.0000
shciscf
An interface to SHCI program Dice developed by Sharma group
Language:PythonApache-2.0000
Spiroborate_Cage
Input and output files for spiroborate cage paper
x2camf
SOC integrals generator with atomic mean field approximation
Language:C++000
zquatev
Python wrapper for qsimulate-open/zquatev
Language:C++000