Skip to content

evaleev/libint

master
Switch branches/tags

Name already in use

A tag already exists with the provided branch name. Many Git commands accept both tag and branch names, so creating this branch may cause unexpected behavior. Are you sure you want to create this branch?
6 branches 49 tags
Code

Latest commit

@evaleev
evaleev Merge pull request #234 from e-kwsm/pep8
a8c8d6b Dec 30, 2022
Merge pull request #234 from e-kwsm/pep8 
PEP8 fixes
a8c8d6b

Git stats

Files

Permalink
Failed to load latest commit information.
Type
Name
Latest commit message
Commit time
.github/workflows
master will become 2.8.0-beta.1
June 20, 2022 08:04
bin
amended boost download path in take_boostpp_snapshot
January 7, 2022 00:01
doc
{set_}scale -> prescale{d}_by
August 9, 2019 17:49
export
fix [W605](https://github.com/PyCQA/pycodestyle/blob/2.8.0/docs/intro…
October 18, 2022 20:53
external
updated bundled boost/preprocessor to work with 947847e and subsequen…
March 28, 2017 10:00
include
fix: throw appropriate exceptions
September 5, 2022 04:33
lib
Fix cc-pvtz-mini.g94
October 12, 2022 14:43
python
fix [E401](https://github.com/PyCQA/pycodestyle/blob/2.8.0/docs/intro…
October 18, 2022 20:53
src
refactor: remove deprecated std::unary_function
October 18, 2022 20:53
tests
fix [W605](https://github.com/PyCQA/pycodestyle/blob/2.8.0/docs/intro…
October 18, 2022 20:53
.gitmodules
adding wiki as a submodule, attempt # 2 (HT https://stackoverflow.com…
August 18, 2019 08:02
.project
added .gitignore and AI logo variant
May 21, 2014 15:06
CHANGES
master will become 2.8.0-beta.1
June 20, 2022 08:04
CITATION
master will become 2.8.0-beta.1
June 20, 2022 08:04
COPYING
(in progress) update license to GPL3/LGPL3 … updated LICENSE files, r…
April 30, 2017 22:26
COPYING.LESSER
(in progress) update license to GPL3/LGPL3 … updated LICENSE files, r…
April 30, 2017 22:26
INSTALL
update
September 8, 2022 22:22
LICENSE
happy 2020!
January 1, 2020 09:53
Makefile
[compiler] removed install_cmake target, fixes compiler's install target
September 19, 2021 14:12
README.md
belated welcome to 2021
September 14, 2021 11:41
autogen.sh
minor update of autogen.sh
March 8, 2017 10:15
configure.ac
master will become 2.8.0-beta.1
June 20, 2022 08:04
libint2.pc.in
bumped to 2.6.0-beta.1
May 7, 2019 13:00

README.md

Libint - a library for the evaluation of molecular integrals of many-body operators over Gaussian functions

See the wiki for the installation and usage instructions.

Copyright (C) 2004-2021 Edward F. Valeev

About

Libint: high-performance library for computing Gaussian integrals in quantum mechanics

Resources

Readme

License

Unknown and 2 other licenses found

Licenses found

Unknown
LICENSE
GPL-3.0
COPYING
LGPL-3.0
COPYING.LESSER

Stars

169 stars

Watchers

25 watching

Forks

88 forks

Releases 38

2.7.2 Latest
Jun 20, 2022
+ 37 releases

Packages

No packages published

Contributors 23

+ 12 contributors

Languages