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Dynamics of Condensed Matter 2256cec575
Support ROKS active-space FCI solver (#5203) 
Co-authored-by: Thomas D. Kuehne <tkuehne@cp2k.org>
2026-05-15 14:15:44 +02:00
..
h2_gpw_ht.inp Update of active space module (#4357) 2025-08-12 12:08:25 +02:00
h2_gpw_ht_group.inp Update of active space module (#4357) 2025-08-12 12:08:25 +02:00
h2_gpw_ht_nostore.inp Update of active space module (#4357) 2025-08-12 12:08:25 +02:00
h2_gpw_ht_nostore_group.inp Update of active space module (#4357) 2025-08-12 12:08:25 +02:00
h2_gpw_ht_roks.inp Add support for ROHF/ROKS in the active space module (#4859) 2026-02-19 13:41:49 +01:00
h2_gpw_nostore.inp Update of active space module (#4357) 2025-08-12 12:08:25 +02:00
h2_gpw_nostore_group.inp Update of active space module (#4357) 2025-08-12 12:08:25 +02:00
TEST_FILES.toml Support ROKS active-space FCI solver (#5203) 2026-05-15 14:15:44 +02:00