/dports/science/quantum-espresso/q-e-qe-6.7.0/PW/src/ |
H A D | set_spin_vars.f90 | 9 SUBROUTINE set_spin_vars( lsda, noncolin, lspinorb, domag, & argument 15 LOGICAL, INTENT(IN) :: lsda, noncolin, lspinorb, domag local
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H A D | ldaU.f90 | 207 LOGICAL, INTENT(IN) :: noncolin component 599 SUBROUTINE copy_U_wfc( swfcatom, noncolin ) argument 606 LOGICAL, INTENT(IN), OPTIONAL :: noncolin local
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H A D | summary.f90 | 479 SUBROUTINE print_symmetries ( iverbosity, noncolin, domag ) argument 504 LOGICAL, INTENT(IN) :: noncolin local
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/dports/science/quantum-espresso/q-e-qe-6.7.0/Modules/ |
H A D | noncol.f90 | 34 noncolin, & ! true if noncollinear magnetism is allowed variable
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H A D | qexsd_init.f90 | 249 class_names, verbosity, noncolin) argument 261 LOGICAL,INTENT(IN) :: noncolin local 413 noncolin, lda_plus_u_kind, U_projection_type, U, U_back, J0, J, & argument 428 LOGICAL,OPTIONAL,INTENT(IN) :: noncolin local 774 SUBROUTINE qexsd_init_magnetization(obj, lsda, noncolin, spinorbit, total_mag, total_mag_nc, & argument 780 LOGICAL, INTENT(IN) :: lsda, noncolin, spinorbit local 792 …SUBROUTINE qexsd_init_band_structure(obj, lsda, noncolin, lspinorb, nelec, n_wfc_at, et, wg, nks,… argument 800 LOGICAL,INTENT(IN) :: lsda, noncolin, lspinorb local
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H A D | qexsd_copy.f90 | 734 lsda, noncolin, lspinorb, domag, tot_magnetization ) argument 742 LOGICAL, INTENT(OUT) :: lsda, noncolin, lspinorb, domag local
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H A D | qes_init_module.f90 | 1430 SUBROUTINE qes_init_spin(obj, tagname, lsda, noncolin, spinorbit) argument 1437 LOGICAL,INTENT(IN) :: noncolin local 2871 …SUBROUTINE qes_init_magnetization(obj, tagname, lsda, noncolin, spinorbit, total, absolute, do_mag… argument 2878 LOGICAL,INTENT(IN) :: noncolin local 2991 SUBROUTINE qes_init_band_structure(obj, tagname, lsda, noncolin, spinorbit, nelec, wf_collected,& argument 3001 LOGICAL,INTENT(IN) :: noncolin local
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H A D | qes_types_module.f90 | 575 LOGICAL :: noncolin component 967 LOGICAL :: noncolin component 1264 LOGICAL :: noncolin component
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H A D | qexsd_input.f90 | 99 SUBROUTINE qexsd_init_spin(obj,lsda,noncolin,spinorbit) argument 104 LOGICAL,INTENT(IN) :: lsda,noncolin,spinorbit local
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H A D | input_parameters.f90 | 476 LOGICAL :: noncolin = .false. variable 642 noncolin, lspinorb, starting_spin_angle, lambda, angle1, angle2, & local
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/dports/science/qmcpack/qmcpack-3.11.0/src/AFQMC/Utilities/ |
H A D | kp_utilities.hpp | 26 bool get_nocc_per_kp(Vector const& nmo_per_kp, CSR const& PsiT, Array&& nocc_per_kp, bool noncolin … in get_nocc_per_kp()
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/dports/science/quantum-espresso/q-e-qe-6.7.0/upflib/ |
H A D | uspp.f90 | 44 LOGICAL, INTENT(IN), OPTIONAL :: noncolin local
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/dports/science/quantum-espresso/q-e-qe-6.7.0/FFTXlib/ |
H A D | fft_helper_subroutines.f90 | 42 SUBROUTINE tg_reduce_rho_1( rhos, tg_rho_nc, tg_rho, ispin, noncolin, domag, desc ) argument 48 LOGICAL, INTENT(IN) :: noncolin, domag local
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/dports/science/quantum-espresso/q-e-qe-6.7.0/GWW/simple_ip/ |
H A D | simple_ip_objects.f90 | 32 LOGICAL :: noncolin ! if it is non-collinear component
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/dports/science/qmcpack/qmcpack-3.11.0/nexus/lib/ |
H A D | pwscf_input.py | 2227 def generate_scf_input(prefix = 'pwscf',
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