Wirawan Purwanto cc95430e06 * Added lmod module for OPENIB-based nwchem installation on Wahab.

2021-04-20 00:29:57 -04:00

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lmod

* Added lmod module for OPENIB-based nwchem installation on Wahab.

2021-04-20 00:29:57 -04:00

build-armci-mpi.sh

* Modifications for building armci-mpi on the Wahab's install location.

2021-04-15 12:40:36 -04:00

BUILD-NOTES.md

* Added small build notes for nwchem on Wahab.

2021-04-15 12:40:55 -04:00

Install-nwchem.mak

* Added make-based install procedure for nwchem 7.0.0.

2021-04-20 00:29:27 -04:00

nwbuild04-ARCMI-MPI-internal-blas-lapack.sh

* Copied "build04" nwchem build script from ODU container repo.

2021-04-14 11:36:44 -04:00

nwbuild05-OPENIB-internal-blas-lapack.sh

* Modularize & tidied up the nwbuild05 script.

2021-04-20 00:28:39 -04:00