Pinned Repositories
2020-software-fellow-posters
CHEM331-PhysicalChemistryI
CHEM331 - Physical Chemistry I
chem370
fomms_integrate
interactive_tutorial_env
molssi_develop_2019
molssi 2019 tutorial
molssi_devops_2019
Package for 2019 workshop!
MultirefPredict
Automated workflow to predict multireference character of molecules in quantum chemistry calculation
QC_JSON_Schema
A JSON Schema for Quantum Chemistry
QCElemental
Periodic table, physical constants, and molecule parsing for quantum chemistry.
ffangliu's Repositories
ffangliu/chem370
ffangliu/MultirefPredict
Automated workflow to predict multireference character of molecules in quantum chemistry calculation
ffangliu/2020-software-fellow-posters
ffangliu/CHEM331-PhysicalChemistryI
CHEM331 - Physical Chemistry I
ffangliu/fomms_integrate
ffangliu/interactive_tutorial_env
ffangliu/molssi_develop_2019
molssi 2019 tutorial
ffangliu/molssi_devops_2019
Package for 2019 workshop!
ffangliu/QC_JSON_Schema
A JSON Schema for Quantum Chemistry
ffangliu/QCElemental
Periodic table, physical constants, and molecule parsing for quantum chemistry.
ffangliu/QCEngine
A wrapper for Quantum Chemistry engines that adheres to the MolSSI QCSchema.
ffangliu/QCEngineParsing
A collection of input and output files for QCEngine parsers.