... | @@ -31,7 +31,7 @@ NWChem: Open Source High-Performance Computational Chemistry. NWChem aims to pro |
... | @@ -31,7 +31,7 @@ NWChem: Open Source High-Performance Computational Chemistry. NWChem aims to pro |
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wget https://github.com/nwchemgit/nwchem/releases/download/v6.8-release/nwchem-6.8-release.revision-v6.8-47-gdf6c956-src.2017-12-14.tar.bz2
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wget https://github.com/nwchemgit/nwchem/releases/download/v6.8-release/nwchem-6.8-release.revision-v6.8-47-gdf6c956-src.2017-12-14.tar.bz2
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# Unpack tar file of src
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# Unpack tar file of src
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tar jxf wchem-6.8-release.revision-v6.8-47-gdf6c956-src.2017-12-14.tar.bz2
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tar jxf nwchem-6.8-release.revision-v6.8-47-gdf6c956-src.2017-12-14.tar.bz2
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# set NWCHEM_TOP to <your path>/nwchem-6.8
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# set NWCHEM_TOP to <your path>/nwchem-6.8
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export NWCHEM_TOP=`pwd`/nwchem-6.8
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export NWCHEM_TOP=`pwd`/nwchem-6.8
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... | @@ -265,7 +265,7 @@ There are a number of failed test cases, see notes note at [end](#testing-2). |
... | @@ -265,7 +265,7 @@ There are a number of failed test cases, see notes note at [end](#testing-2). |
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wget https://github.com/nwchemgit/nwchem/releases/download/v6.8-release/nwchem-6.8-release.revision-v6.8-47-gdf6c956-src.2017-12-14.tar.bz2
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wget https://github.com/nwchemgit/nwchem/releases/download/v6.8-release/nwchem-6.8-release.revision-v6.8-47-gdf6c956-src.2017-12-14.tar.bz2
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# Unpack tar file of src
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# Unpack tar file of src
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tar jxf wchem-6.8-release.revision-v6.8-47-gdf6c956-src.2017-12-14.tar.bz2
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tar jxf nwchem-6.8-release.revision-v6.8-47-gdf6c956-src.2017-12-14.tar.bz2
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# set NWCHEM_TOP to <your path>/nwchem-6.8
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# set NWCHEM_TOP to <your path>/nwchem-6.8
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export NWCHEM_TOP=`pwd`/nwchem-6.8
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export NWCHEM_TOP=`pwd`/nwchem-6.8
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... | | ... | |