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Searched refs:work_orb_orb (Results 1 – 7 of 7) sorted by relevance

/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dadmm_methods.F733 admm_env%work_orb_orb)
737 1.0_dp, admm_env%A, admm_env%work_orb_orb, 0.0_dp, &
814 admm_env%work_orb_orb)
961 admm_env%work_orb_orb)
976 1.0_dp, admm_env%work_orb_orb, mo_coeff, 0.0_dp, &
1242 admm_env%work_orb_orb)
1633 admm_env%work_orb_orb)
1806 admm_env%work_orb_orb)
1809 -1.0_dp, admm_env%A, admm_env%work_orb_orb, 1.0_dp, &
1819 admm_env%work_orb_orb)
[all …]
H A Dadmm_types.F80 work_orb_orb => Null(), & component
202 CALL cp_fm_create(admm_env%work_orb_orb, fm_struct_orb_orb, name="work_orb_orb")
348 CALL cp_fm_release(admm_env%work_orb_orb)
H A Drtp_admm_methods.F501 admm_env%work_orb_orb)
512 CALL copy_fm_to_dbcsr(admm_env%work_orb_orb, matrix_k_tilde, keep_sparsity=.TRUE.)
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dadmm_methods.F962 admm_env%work_orb_orb)
966 1.0_dp, admm_env%A, admm_env%work_orb_orb, 0.0_dp, &
1043 admm_env%work_orb_orb)
1190 admm_env%work_orb_orb)
1205 1.0_dp, admm_env%work_orb_orb, mo_coeff, 0.0_dp, &
1471 admm_env%work_orb_orb)
1926 admm_env%work_orb_orb)
2099 admm_env%work_orb_orb)
2102 -1.0_dp, admm_env%A, admm_env%work_orb_orb, 1.0_dp, &
2112 admm_env%work_orb_orb)
[all …]
H A Dresponse_solver.F261 CPASSERT(ASSOCIATED(admm_env%work_orb_orb))
267 CALL copy_dbcsr_to_fm(p_env%p1(ispin)%matrix, admm_env%work_orb_orb)
269 1.0_dp, admm_env%A, admm_env%work_orb_orb, 0.0_dp, &
750 admm_env%work_orb_orb)
753 CALL copy_fm_to_dbcsr(admm_env%work_orb_orb, dbwork, keep_sparsity=.TRUE.)
806 CPASSERT(ASSOCIATED(admm_env%work_orb_orb))
816 admm_env%work_orb_orb)
819 CALL copy_fm_to_dbcsr(admm_env%work_orb_orb, dbwork, keep_sparsity=.TRUE.)
964 CALL copy_dbcsr_to_fm(matrix_pz(ispin)%matrix, admm_env%work_orb_orb)
967 admm_env%work_orb_orb, 0.0_dp, admm_env%work_aux_orb2)
H A Dadmm_types.F105 work_orb_orb => Null(), & component
229 CALL cp_fm_create(admm_env%work_orb_orb, fm_struct_orb_orb, name="work_orb_orb")
379 CALL cp_fm_release(admm_env%work_orb_orb)
H A Drtp_admm_methods.F509 admm_env%work_orb_orb)
520 CALL copy_fm_to_dbcsr(admm_env%work_orb_orb, matrix_k_tilde, keep_sparsity=.TRUE.)