e4s ci stacks: add nwchem (#47055)

2024-10-18 14:30:46 -07:00
parent 31cfcafeba
commit df6427d259
5 changed files with 5 additions and 0 deletions
--- a/share/spack/gitlab/cloud_pipelines/stacks/e4s-neoverse-v2/spack.yaml
+++ b/share/spack/gitlab/cloud_pipelines/stacks/e4s-neoverse-v2/spack.yaml
@@ -114,6 +114,7 @@ spack:
  - netlib-scalapack
  - nrm
  # - nvhpc
+  - nwchem 
  - omega-h
  - openfoam
  # - openmpi
--- a/share/spack/gitlab/cloud_pipelines/stacks/e4s-neoverse_v1/spack.yaml
+++ b/share/spack/gitlab/cloud_pipelines/stacks/e4s-neoverse_v1/spack.yaml
@@ -115,6 +115,7 @@ spack:
  - netlib-scalapack
  - nrm
  - nvhpc
+  - nwchem
  - omega-h
  - openfoam
  - openmpi
--- a/share/spack/gitlab/cloud_pipelines/stacks/e4s-oneapi/spack.yaml
+++ b/share/spack/gitlab/cloud_pipelines/stacks/e4s-oneapi/spack.yaml
@@ -128,6 +128,7 @@ spack:
  - nco
  - netlib-scalapack
  - nrm
+  - nwchem
  - omega-h
  - openfoam
  - openmpi
--- a/share/spack/gitlab/cloud_pipelines/stacks/e4s-power/spack.yaml
+++ b/share/spack/gitlab/cloud_pipelines/stacks/e4s-power/spack.yaml
@@ -118,6 +118,7 @@ spack:
  - netlib-scalapack
  - nrm
  - nvhpc
+  - nwchem
  - omega-h
  - openfoam
  - openmpi
--- a/share/spack/gitlab/cloud_pipelines/stacks/e4s/spack.yaml
+++ b/share/spack/gitlab/cloud_pipelines/stacks/e4s/spack.yaml
@@ -129,6 +129,7 @@ spack:
  - netlib-scalapack
  - nrm
  - nvhpc
+  - nwchem
  - omega-h
  - openfoam
  - openmpi