zishengz
Stanford Energy Fellow @SLAC | PhD in Theo.&Comput. Chemistry @ UCLA
Stanford UniversityPalo Alto, CA
Pinned Repositories
damage-calc
Pokemon games damage calculator
2019-Fall
https://SUSTech-Application.github.io/2019-Fall
criticAnalyzer
python scripts for extracting key data from critic2 output
echo
Electro-Chemical Optimizer
gocia
Global Optimizer for Clusters, Interfaces, and Adsorbates
jdftx
JDFTx: software for joint density functional theory
molga-mpc
Molecular Genetic Algorithm for Metal Phthalocyanine
vasp_raman_surf
A set of scripts for flexible Raman off-resonant activity calculation for surface slabs, using VASP as a DFT back-end.
zishengz.github.io
http://zishengz.github.io
zishengz.github.io_old
Blog
zishengz's Repositories
zishengz/gocia
Global Optimizer for Clusters, Interfaces, and Adsorbates
zishengz/vasp_raman_surf
A set of scripts for flexible Raman off-resonant activity calculation for surface slabs, using VASP as a DFT back-end.
zishengz/echo
Electro-Chemical Optimizer
zishengz/zishengz.github.io_old
Blog
zishengz/criticAnalyzer
python scripts for extracting key data from critic2 output
zishengz/jdftx
JDFTx: software for joint density functional theory
zishengz/molga-mpc
Molecular Genetic Algorithm for Metal Phthalocyanine
zishengz/zishengz.github.io
http://zishengz.github.io
zishengz/2019-Fall
https://SUSTech-Application.github.io/2019-Fall
zishengz/aenet
Atomic interaction potentials based on artificial neural networks
zishengz/TCCL-Code
Code and scripts for theoretical and computational chemistry, developed in TCCL, Department of Chemistry, Tsinghua University. These scripts read the out put of ADF, CP2K, Dmol3, Gaussian, NWChem, Molpro program.
zishengz/ase
Atomic Simulation Environment - unofficial mirror from https://gitlab.com/ase/ase
zishengz/cp2k
Quantum chemistry and solid state physics software package
zishengz/Cu_100_row_shifting
Data repo
zishengz/honko-damagecalc
Pokemon games damage calculator
zishengz/jarvis
JARVIS-Tools: an open-source software package for data-driven atomistic materials design
zishengz/openbabel
Open Babel is a chemical toolbox designed to speak the many languages of chemical data.
zishengz/PGOPT
Parallel global optimization of gas phase and surface systems
zishengz/ProgrammingProjects
C++ Programming Tutorial in Chemistry
zishengz/pymatgen
Python Materials Genomics (pymatgen) is a robust materials analysis code that defines core object representations for structures and molecules with support for many electronic structure codes. It is currently the core analysis code powering the Materials Project.
zishengz/pyscf
Python module for quantum chemistry
zishengz/scripts
zishengz/subnano_cluster_orr_ensemble
optimized structure of M4 (M=Pt,Pd,Au,Ag) supported on graphite
zishengz/zishengz