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Searched refs:qs_forces (Results 1 – 6 of 6) sorted by relevance

/dports/science/cp2k-data/cp2k-7.1.0/benchmarks/QS_pao_ml_tio2/
H A DREADME.md72 qs_forces 21 4.0 0.300 0.313 8731.917 8731.935
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/benchmarks/QS_pao_ml_tio2/
H A DREADME.md72 qs_forces 21 4.0 0.300 0.313 8731.917 8731.935
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dqs_force.F114 CALL qs_forces(qs_env)
129 SUBROUTINE qs_forces(qs_env) subroutine
462 END SUBROUTINE qs_forces
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dqs_force.F113 CALL qs_forces(qs_env)
128 SUBROUTINE qs_forces(qs_env) subroutine
456 END SUBROUTINE qs_forces
/dports/science/cp2k-data/cp2k-7.1.0/benchmarks/QS_stmv/
H A DREADME.md26 qs_forces 2 6.0 0.831 1.322 8223.245 8223.380
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/benchmarks/QS_stmv/
H A DREADME.md26 qs_forces 2 6.0 0.831 1.322 8223.245 8223.380