jxzhangcc's Stars
gaox-qd/pysoc
PySOC: python+fortran, spin-orbit coupling, LR-TD-DFT, TDA, TD-DFTB, Gaussian 09, DFTB+
CurtisColwell/StrainViz
Strain Visualization for Inherently Strained Organic Molecules
jxzhangcc/PIO
Principal Interacting Orbital