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cell_opt_constraint_none.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cell_opt_constraint_xy.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cell_opt_constraint_z.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cell_opt_direct_bfgs.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cell_opt_direct_cg_2pnt.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cell_opt_direct_cg_gold.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cell_opt_direct_lbfgs.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cell_opt_keep_volume.inp
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Switch to Fist tests per mkrack's suggestion
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2026-04-25 09:39:16 +02:00 |
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cell_opt_keep_volume_symmetry.inp
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Switch to Fist tests per mkrack's suggestion
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2026-04-25 09:39:16 +02:00 |
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cell_sym_cubic.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cell_sym_hexagonal.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cell_sym_hexagonal_gamma_60.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cell_sym_hexagonal_gamma_120.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cell_sym_monoclinic.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cell_sym_monoclinic_gamma_ab.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cell_sym_none.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cell_sym_orthorhombic.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cell_sym_rhombohedral.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cell_sym_tetragonal.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cell_sym_tetragonal_ab.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cell_sym_tetragonal_ac.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cell_sym_tetragonal_bc.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cell_sym_triclinic.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cs_cell_opt_direct_bfgs.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cs_cell_opt_direct_cg_2pnt.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cs_cell_opt_direct_cg_gold.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cs_cell_opt_direct_lbfgs.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
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cs_geo_opt_bfgs.inp
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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cs_geo_opt_cg_2pnt.inp
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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cs_geo_opt_cg_fit.inp
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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cs_geo_opt_cg_gold.inp
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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cs_geo_opt_lbfgs.inp
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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geo_opt_bfgs.inp
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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geo_opt_cg_2pnt.inp
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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geo_opt_cg_fit.inp
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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geo_opt_cg_gold.inp
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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geo_opt_lbfgs.inp
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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mc_cs_geo_opt_lbfgs.inp
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gfn0-xTB and parallel DFT-D4 (#3765)
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2024-11-08 17:48:34 +01:00 |
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TEST_FILES.toml
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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2026-05-21 17:31:40 +02:00 |
