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dft-inputs
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Add units to QE ATOMIC_POSITIONS
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2024-02-14 19:02:16 -05:00 |
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fake_nspin2
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Set driver_version in inputs
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2025-01-08 13:53:45 -05:00 |
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qmc-ref
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Add solid multi-slater jastrow test reference files.
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2019-04-17 21:44:59 -07:00 |
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CMakeLists.txt
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Increase short-LiH_solid_1x1x1_pp-x-dmc-hf_noj-1-16-totenergy error
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2024-09-23 11:35:42 -04:00 |
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H.xml
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Partial move of tests:
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2015-08-17 19:51:53 +00:00 |
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Li.xml
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Partial move of tests:
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2015-08-17 19:51:53 +00:00 |
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LiH-arb.pwscf.h5
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Partial move of tests:
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2015-08-17 19:51:53 +00:00 |
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LiH-gamma.pwscf.h5
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Partial move of tests:
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2015-08-17 19:51:53 +00:00 |
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LiH-x.pwscf.h5
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Partial move of tests:
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2015-08-17 19:51:53 +00:00 |
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clean.sh
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Partial move of tests:
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2015-08-17 19:51:53 +00:00 |
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det_ensemble_blocks_hf_vmc_LiH-gamma.txt
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Ensemble test
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2022-07-01 18:34:04 -04:00 |
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det_ensemble_blocks_hf_vmc_LiH-gamma_0.xml
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Set driver_version in inputs
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2025-01-08 13:53:45 -05:00 |
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det_ensemble_blocks_hf_vmc_LiH-gamma_1.xml
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Set driver_version in inputs
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2025-01-08 13:53:45 -05:00 |
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det_ensemble_blocks_hf_vmc_LiH-gamma_2.xml
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Set driver_version in inputs
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2025-01-08 13:53:45 -05:00 |
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det_ensemble_blocks_hf_vmc_LiH-gamma_3.xml
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Set driver_version in inputs
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2025-01-08 13:53:45 -05:00 |
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det_hf_vmc_LiH-gamma.xml
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Set driver_version in inputs
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2025-01-08 13:53:45 -05:00 |
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hf_vmc_LiH-arb-drift.xml
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Set driver_version in inputs
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2025-01-08 13:53:45 -05:00 |
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hf_vmc_LiH-arb.xml
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Set driver_version in inputs
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2025-01-08 13:53:45 -05:00 |
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hf_vmc_LiH-gamma-drift.xml
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Set driver_version in inputs
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2025-01-08 13:53:45 -05:00 |
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hf_vmc_LiH-gamma.xml
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Set driver_version in inputs
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2025-01-08 13:53:45 -05:00 |
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hf_vmc_LiH-x-drift.xml
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Set driver_version in inputs
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2025-01-08 13:53:45 -05:00 |
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hf_vmc_LiH-x.xml
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Set driver_version in inputs
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2025-01-08 13:53:45 -05:00 |
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hf_vmc_LiH-x_hybridrep.xml
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Set driver_version in inputs
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2025-01-08 13:53:45 -05:00 |
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hf_vmc_dmc_short_LiH-arb.xml
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Set driver_version in inputs
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2025-01-08 13:53:45 -05:00 |
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hf_vmc_dmc_short_LiH-gamma.xml
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Set driver_version in inputs
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2025-01-08 13:53:45 -05:00 |
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hf_vmc_dmc_short_LiH-x.xml
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Set driver_version in inputs
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2025-01-08 13:53:45 -05:00 |
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hf_vmc_dmcnl_short_LiH-arb.xml
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Set driver_version in inputs
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2025-01-08 13:53:45 -05:00 |
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hf_vmc_dmcnl_short_LiH-gamma.xml
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Set driver_version in inputs
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2025-01-08 13:53:45 -05:00 |
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hf_vmc_dmcnl_short_LiH-x.xml
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Set driver_version in inputs
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2025-01-08 13:53:45 -05:00 |
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md_cc_vmc_LiH-gamma.xml
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Set driver_version in inputs
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2025-01-08 13:53:45 -05:00 |
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md_rc_vmc_LiH-gamma.xml
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Set driver_version in inputs
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2025-01-08 13:53:45 -05:00 |
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