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new nvfortran simint step

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edoapra 2021-05-11 10:43:28 -07:00
parent a1a55750b4
commit 08a9df8520
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9
.github/workflows/github_actions.yml vendored
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@ -93,6 +93,14 @@ jobs:
nwchem_modules: "nwdft solvation driver"
fc: gfortran-10
use_simint: 1
- os: ubuntu-20.04
experimental: true
mpi_impl: mpich
armci_network: mpi-ts
nwchem_modules: "tinyqmpw python"
fc: nvfortran
cc: gcc
use_simint: 1
- os: ubuntu-20.04
experimental: true
mpi_impl: mpich
@ -143,6 +151,7 @@ jobs:
NWCHEM_MODULES: ${{ matrix.nwchem_modules }}
USE_SIMINT: ${{ matrix.use_simint }}
FC: ${{ matrix.fc }}
CC: ${{ matrix.cc }}
COMEX_MAX_NB_OUTSTANDING: 4
SIMINT_MAXAM: 3
SIMINT_VECTOR: avx2