Laboratoire de Chimie et Physique Quantiques
Toulouse, France
http://www.lcpq.ups-tlse.fr
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qp2
Fortran 1 0

Quantum Package : a programming environment for wave function methods

irpf90
ocaml
post-hf
cipsi
post-hartr

Updated 1 hour ago

dft_tools
Python 0 0

Updated 21 hours ago

Cost_package
1 0

Cost_package backup

Updated 1 month ago

QCaml
Jupyter Notebook 1 0

Quantum chemistry written with OCaml

post-hf
ocaml

Updated 2 months ago

quack
Fortran 1 0

Updated 2 months ago

lcpq-codes
Markdown 1 0

Source code running LCPQ code subsite

Updated 4 months ago

irpf90
Python 0 0

Fortran90 preprocessor for programming using the Implicit Reference to Parameters (IRP) method. It simplifies the development of large fortran codes in the field of scientific high performance computing.

irpf90
fortran

Updated 6 months ago

resultsFile
Python 0 0

Python ilbrary to parse output files of Gaussian, Gamess and Molpro

python

Updated 8 months ago

qmcchem
Fortran 1 1

Quantum Monte Carlo program

irpf90
qmc

Updated 1 year ago

Crystal-MET
Python 0 0

Updated 1 year ago

EZFIO
Python 0 0

Easy Fortran I/O library generator

irpf90
ocaml
fortran
python

Updated 1 year ago

eplf
Fortran 0 0

Computes the Electron Pair Localization Function

Updated 3 years ago

DEHam
C 0 0

Updated 3 years ago

quantum_package
Fortran 0 0

This repository is version 1 of QP. This version is not supported any more. Version 2 is available here : https://github.com/QuantumPackage/qp2

Updated 4 years ago

EMSL_Basis_Set_Exchange_Local
Python 0 0

Updated 5 years ago

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