MPI-FKF Electronic Structure Theory

Electronic Structure Theory Department @ Max Planck Institute for Solid State Research (MPI-FKF)

Germany

Pinned Repositories

ElemCo.jl
Julia implementation of various electron-correlation methods (main focus on coupled cluster methods).
Language:TeX112
quantwo
second quantization program
Language:C++72
dumpham
Language:C++10
csvfwf
Language:Python10
ccdiag
Coupled cluster diagram package
Language:TeX10
molcaspro
Transform MOLCAS orbitals to MOLPRO orbitals (and vice versa) by matching overlap matrices.
Language:Shell00

MPI-FKF Electronic Structure Theory's Repositories

fkfest/quantwo
second quantization program
Language:C++72
fkfest/ElemCo.jl
Julia implementation of various electron-correlation methods (main focus on coupled cluster methods).
Language:TeX112
fkfest/dumpham
Language:C++1
fkfest/molcaspro
Transform MOLCAS orbitals to MOLPRO orbitals (and vice versa) by matching overlap matrices.
Language:Shell
fkfest/ccdiag
Coupled cluster diagram package
Language:TeX1
fkfest/csvfwf
Language:Python1