| /dports/science/quantum-espresso/q-e-qe-6.7.0/test-suite/epw_polar/ |
| H A D | benchmark.out.git.inp=nscf_epw.in.args=1 | 20 Max number of k-points (npk) = 40000
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| /dports/science/quantum-espresso/q-e-qe-6.7.0/test-suite/pw_dft/ |
| H A D | benchmark.out.git.inp=dft5.in | 16 Max number of k-points (npk) = 40000
|
| /dports/science/quantum-espresso/q-e-qe-6.7.0/test-suite/pw_metal/ |
| H A D | benchmark.out.git.inp=metal.in | 16 Max number of k-points (npk) = 40000
|
| /dports/science/py-phonopy/phonopy-2.11.0/example/Si-QE/ |
| H A D | supercell-001.out | 24 Max number of k-points (npk) = 40000
241 Max number of k-points (npk) = 40000
452 Max number of k-points (npk) = 40000
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| /dports/science/py-pyscf/pyscf-2.0.1/pyscf/lib/gto/test/ |
| H A D | test_ecp.py | 348 npk = ecpsh[NPRIM_OF]
350 ak = mol._env[ecpsh[PTR_EXP]:ecpsh[PTR_EXP]+npk]
351 ck = mol._env[ecpsh[PTR_COEFF]:ecpsh[PTR_COEFF]+npk]
|
| /dports/science/phonopy/phonopy-2.11.0/example/Si-QE/ |
| H A D | supercell-001.out | 24 Max number of k-points (npk) = 40000
241 Max number of k-points (npk) = 40000
452 Max number of k-points (npk) = 40000
|
| /dports/science/quantum-espresso/q-e-qe-6.7.0/test-suite/pw_lattice-ibrav/ |
| H A D | benchmark.out.git.inp=lattice-ibrav-12-kauto.in | 20 Max number of k-points (npk) = 40000
|
| H A D | benchmark.out.git.inp=lattice-ibrav-12.in | 20 Max number of k-points (npk) = 40000
|
| H A D | benchmark.out.git.inp=lattice-ibrav1.in | 20 Max number of k-points (npk) = 40000
|
| H A D | benchmark.out.git.inp=lattice-ibrav10.in | 20 Max number of k-points (npk) = 40000
|
| H A D | benchmark.out.git.inp=lattice-ibrav11.in | 20 Max number of k-points (npk) = 40000
|
| H A D | benchmark.out.git.inp=lattice-ibrav12.in | 20 Max number of k-points (npk) = 40000
|
| H A D | benchmark.out.git.inp=lattice-ibrav13-kauto.in | 20 Max number of k-points (npk) = 40000
|
| H A D | benchmark.out.git.inp=lattice-ibrav4-kauto.in | 20 Max number of k-points (npk) = 40000
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| H A D | benchmark.out.git.inp=lattice-ibrav8-kauto.in | 20 Max number of k-points (npk) = 40000
|
| /dports/science/quantum-espresso/q-e-qe-6.7.0/test-suite/pw_scf/ |
| H A D | benchmark.out.git.inp=scf-ncpp.in | 16 Max number of k-points (npk) = 40000
|
| H A D | benchmark.out.git.inp=scf-disk_io.in | 16 Max number of k-points (npk) = 40000
|
| H A D | benchmark.out.git.inp=scf-gamma.in | 16 Max number of k-points (npk) = 40000
|
| H A D | benchmark.out.git.inp=scf-k0.in | 16 Max number of k-points (npk) = 40000
|
| H A D | benchmark.out.git.inp=scf-nofrac.in | 16 Max number of k-points (npk) = 40000
|
| /dports/science/quantum-espresso/q-e-qe-6.7.0/test-suite/pw_workflow_vc-relax_dos/ |
| H A D | benchmark.out.git.inp=dos2.in.args=2 | 25 Max number of k-points (npk) = 40000
|
| /dports/science/quantum-espresso/q-e-qe-6.7.0/test-suite/pw_workflow_scf_dos/ |
| H A D | benchmark.out.git.inp=dos2.in.args=2 | 25 Max number of k-points (npk) = 40000
|
| /dports/science/quantum-espresso/q-e-qe-6.7.0/PP/examples/WorkFct_example/reference/ |
| H A D | Al.bulkref.out | 9 Max number of k-points (npk) = 40000
|
| /dports/science/quantum-espresso/q-e-qe-6.7.0/PW/examples/example01/reference/ |
| H A D | cu.band.cg.out | 22 Max number of k-points (npk) = 40000
|
| H A D | si.band.ppcg.out | 25 Max number of k-points (npk) = 40000
|