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QA/H13-Oct-2020-13,736,11411,562,777

contrib/H13-Oct-2020-181,819165,660

doc/H13-Oct-2020-42,25135,853

examples/H13-Oct-2020-256,422254,753

src/H13-Oct-2020-9,245,9778,064,956

travis/H13-Oct-2020-316285

web/H03-May-2022-10,2778,846

.gitignoreH A D13-Oct-20201.3 KiB10884

.gitlab-ci.ymlH A D13-Oct-20207.7 KiB254232

.travis.ymlH A D13-Oct-20204.6 KiB168156

INSTALLH A D13-Oct-202028.9 KiB732562

INSTALL.binbuildsH A D13-Oct-20202.1 KiB5039

README.mdH A D13-Oct-20202.7 KiB4629

release.notes.3.2.1H A D13-Oct-202016.5 KiB435364

release.notes.3.3H A D13-Oct-202014.1 KiB314266

release.notes.4.0H A D13-Oct-202012.1 KiB288236

release.notes.4.1H A D13-Oct-202012.4 KiB307236

release.notes.4.5H A D13-Oct-20209.2 KiB246191

release.notes.4.6H A D13-Oct-20206.9 KiB190152

release.notes.4.7H A D13-Oct-20204.7 KiB10683

release.notes.5.0H A D13-Oct-20203.5 KiB7563

release.notes.5.1H A D13-Oct-20202.4 KiB6050

release.notes.5.1.1H A D13-Oct-20201.8 KiB4333

release.notes.6.0H A D13-Oct-20201.8 KiB4334

release.notes.6.1H A D13-Oct-20204 KiB11088

release.notes.6.8H A D13-Oct-20202.9 KiB8561

release.notes.6.8.1H A D13-Oct-2020895 3418

release.notes.7.0.0H A D13-Oct-20201.9 KiB6939

release.notes.7.0.1H A D13-Oct-20201.1 KiB4120

release.notes.7.0.2H A D13-Oct-20201.1 KiB4221

README.md

1
2
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4
5[![Build Travis-CI Status](https://img.shields.io/travis/nwchemgit/nwchem.svg)](https://travis-ci.org/nwchemgit/nwchem/builds)
6[![License](https://img.shields.io/badge/license-ECL2-blue.svg)](https://raw.githubusercontent.com/nwchemgit/nwchem/master/LICENSE.md)
7[![Github Downloads All Releases](https://img.shields.io/github/downloads/nwchemgit/nwchem/total.svg)](https://github.com/nwchemgit/nwchem/releases)
8[![Github Downloads Release 6.8](https://img.shields.io/github/downloads/nwchemgit/nwchem/v6.8-release/total.svg)](https://github.com/nwchemgit/nwchem/releases/tag/v6.8-release)
9[![Github Downloads Release 6.8.1](https://img.shields.io/github/downloads/nwchemgit/nwchem/6.8.1-release/total.svg)](https://github.com/nwchemgit/nwchem/releases/tag/6.8.1-release)
10[![Github Downloads Release 7.0.0](https://img.shields.io/github/downloads/nwchemgit/nwchem/v7.0.0-release/total.svg)](https://github.com/nwchemgit/nwchem/releases/tag/v7.0.0-release)
11[![Github Downloads Release 7.0.1](https://img.shields.io/github/downloads/nwchemgit/nwchem/v7.0.1-release/total.svg)](https://github.com/nwchemgit/nwchem/releases/tag/v7.0.1-release)
12
13
14[![All Releases tags](https://img.shields.io/github/release/nwchemgit/nwchem/all.svg)](https://github.com/nwchemgit/nwchem/releases)
15[![EMSL](https://rawgit.com/nwchemgit/nwchem/master/contrib/git.nwchem/emsl_logo2.svg)](https://www.emsl.pnl.gov)
16
17## NWChem: Open Source High-Performance Computational Chemistry
18<img alt="NWChem logo" src="https://raw.githubusercontent.com/nwchemgit/nwchem/master/contrib/git.nwchem/MS3_logo_cropped.png" align=middle width="102pt" height="117pt"/>
19NWChem is actively developed by a consortium of developers and maintained by the Environmental Molecular Sciences Laboratory (EMSL), a US DOE Office of Science User Facility
20located at the Pacific Northwest National Laboratory (PNNL) in Washington State
21
22### Scalable computational chemistry tools
23
24Source download instructions
25
26* Master
27
28git clone https://github.com/nwchemgit/nwchem.git
29
30* 7.0.1 Release
31
32git clone  -b hotfix/release-7-0-0 https://github.com/nwchemgit/nwchem.git nwchem-7.0.1
33
34### Release 7.0.1
35
36Release files available at the page
37https://github.com/nwchemgit/nwchem/releases/tag/v7.0.1-release
38Tar files for download:
39https://github.com/nwchemgit/nwchem/releases/download/v7.0.1-release/nwchem-7.0.1-release.revision-9d9840c2-srconly.2020-10-08.tar.bz2
40https://github.com/nwchemgit/nwchem/releases/download/v7.0.1-release/nwchem-7.0.1-release.revision-9d9840c2-nonsrconly.2020-10-08.tar.bz2
41Release notes available at
42https://raw.githubusercontent.com/nwchemgit/nwchem/v7.0.1-release/release.notes.7.0.1
43
44### Documentation
45https://nwchemgit.github.io
46