jingslaw
a physics graduated student in University of Science and Technology of China, whose main interests are about first principle calculation.
USTC, Hefei, Anhui, China
Pinned Repositories
ab-crystal-library
An offline crystal library, which includes about tens of thousand structure calculated by VASP.
cluster_embedded_model
A tools to build the cluster embedded model for MOLCAS
self-consist_concentration_calculation
A self-consist method to calculate all potential defects concentration
ToMolcas
Some method to Molacas calculation
VASP_FILE_SETTING
give some tools to deal with output and input file in VASP, and now is still proceeding
jingslaw's Repositories
jingslaw/ab-crystal-library
An offline crystal library, which includes about tens of thousand structure calculated by VASP.
jingslaw/self-consist_concentration_calculation
A self-consist method to calculate all potential defects concentration
jingslaw/cluster_embedded_model
A tools to build the cluster embedded model for MOLCAS
jingslaw/ToMolcas
Some method to Molacas calculation
jingslaw/VASP_FILE_SETTING
give some tools to deal with output and input file in VASP, and now is still proceeding