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edoapra 2022-02-28 19:21:58 -08:00
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contrib/quasar/README.md
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@ -2,7 +2,7 @@ Using NWChem with Microsoft Quantum Development Kit
=================================================== ===================================================
Instructions on building and running NWChem are available Instructions on building and running NWChem are available
[here](http://www.nwchem-sw.org/index.php/Main_Page). [here](https://nwchemgit.github.io).
Alternatively, you can run the NWChem docker image using the Alternatively, you can run the NWChem docker image using the
instructions at: instructions at:

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contrib/rpm_spec_file/nwchem-6-5.spec
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@ -100,7 +100,7 @@ Summary: Parallel Ab-Initio Quantum Chemistry Code
Group: Applications/Scientific Group: Applications/Scientific
License: Various: NWChem: ECL2.0; Global Arrays: OpenSource; OpenMPI: New BSD License: Various: NWChem: ECL2.0; Global Arrays: OpenSource; OpenMPI: New BSD
URL: http://www.nwchem-sw.org URL: https://nwchemgit.github.io
Source0: nwchem-6.5.tar.gz Source0: nwchem-6.5.tar.gz
Source1: openmpi-1.8.4.tar.gz Source1: openmpi-1.8.4.tar.gz
BuildRoot: %(mktemp -ud %{_tmppath}/%{name}-%{version}-%{release}-XXXXXX) BuildRoot: %(mktemp -ud %{_tmppath}/%{name}-%{version}-%{release}-XXXXXX)
@ -109,7 +109,7 @@ BuildRequires: gcc == 4.4.7
%description %description
NWChem parallel ab-initio quantum chemistry code targetting computer systems. \ NWChem parallel ab-initio quantum chemistry code targetting computer systems. \
For more details see: http://www.nwchem-sw.org For more details see: https://nwchemgit.github.io
%prep %prep