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acn-3.inp
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argon_opt_cell.inp
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Motion: Remove &CELL_OPT/TYPE keyword (#5257)
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argon_opt_cell_ks.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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bonded-1.inp
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bonded-2.inp
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bonded-3.inp
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ch4legendre.inp
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ethene_colv3.inp
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H2O-constr_1_ext.inp
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H2O-fixd-rest-2.inp
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H2O-fixd-rest.inp
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H2O-restraint_1.inp
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H2O-restraint_1_ext.inp
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H2O-restraint_2.inp
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H2OFe-5_75-3.inp
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H2OFe-5_75-4.inp
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H2OFe-5_75-5.inp
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H2OFe-5_75-6.inp
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H2OFe-5_75-7.inp
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interface-2.inp
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interface.inp
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mfi.inp
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mfi_geo.inp
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mfi_geo2.inp
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mfi_geo2_extxyz.inp
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Add extended XYZ format for trajectories
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2025-12-11 14:50:20 +01:00 |
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mfi_geo3.inp
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nh3_4x6_ext.inp
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nh3_4x6_fixd.inp
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nh3_fixd_x.inp
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nh3_fixd_xy.inp
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nh3_fixd_y.inp
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nh3_fixd_z.inp
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nh3_r4x6_ext.inp
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nptf_ortho.inp
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nptf_ortho_screen.inp
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Si_tersoff.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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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 |
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test_pair.inp
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test_ub1.inp
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test_ub2.inp
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water32_hbonds_3.inp
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water32_hbonds_4.inp
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water_3_dist_2.inp
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water_3_dist_2_restr.inp
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water_3_dist_3.inp
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water_3_dist_inter.inp
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water_3_dist_inter2.inp
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water_3_dist_mix.inp
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water_3_dist_startC.inp
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water_3_g3x3_ext.inp
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water_3_g3x3_fxd.inp
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water_3_rg3x3_ext.inp
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water_massive.inp
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