Pinned Repositories
abiconfig
Configuration files to configure/compile Abinit
abiflows
High-throughput calculations with Abinit
abinit
Github mirror of the Abinit repository (stable branch). We welcome bug fixes and improvements. Note that most of the active developments are hosted on our https://gitlab.abinit.org/ server. Before embarking on making significant changes, please contact the Abinit group.
abinit_issues
Bug reports and known issues for Abinit
abipy
Open-source library for analyzing the results produced by ABINIT
abitutorials
Abinit tutorials based on AbiPy
cp2k
Mirror of official svn repository at sourceforge. Synced every 5 minutes.
DeltaCodesDFT
Scripts needed to generate the Delta factor for two solid state DFT codes within the PBE formalism
GW100
GW100 data repository and post processing tools
HTGW
Package for automatic GW calculations.
setten's Repositories
setten/GW100
GW100 data repository and post processing tools
setten/HTGW
Package for automatic GW calculations.
setten/abiconfig
Configuration files to configure/compile Abinit
setten/abiflows
High-throughput calculations with Abinit
setten/abinit
Github mirror of the Abinit repository (stable branch). We welcome bug fixes and improvements. Note that most of the active developments are hosted on our https://gitlab.abinit.org/ server. Before embarking on making significant changes, please contact the Abinit group.
setten/abinit_issues
Bug reports and known issues for Abinit
setten/abipy
Open-source library for analyzing the results produced by ABINIT
setten/abitutorials
Abinit tutorials based on AbiPy
setten/cp2k
Mirror of official svn repository at sourceforge. Synced every 5 minutes.
setten/DeltaCodesDFT
Scripts needed to generate the Delta factor for two solid state DFT codes within the PBE formalism
setten/hb-test
setten/lammps
Public development project of the LAMMPS MD software package
setten/nbjsmol
setten/periodic-table-plotter
Make periodic table map plots and pettifor-style trend plots.
setten/pseudo_dojo
setten/PyBench
Package for preforming benchmark calculations of abinitio codes
setten/pycp2k
Python Cp2k interface
setten/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.
setten/slufl2
Run Ansible playbooks when LDAP entries change.
setten/yMap
An automated method to map yeast variants to proteins modifications and functional regions