Searched refs:npw0 (Results 1 – 7 of 7) sorted by relevance
| /dports/science/quantum-espresso/q-e-qe-6.7.0/GWW/pw4gww/ |
| H A D | dft_exchange.f90 | 60 INTEGER :: npw0 local
103 CALL gk_sort(xk(1,1),ngm,g,gcutw,npw0,igk0,g2kin_bp)
124 psic(dffts%nl(1:npw0)) = ks_wfcs(1:npw0,hw,isv) + &
125 ( 0.D0, 1.D0 ) * ks_wfcs(1:npw0,hw+1,isv)
129 psic(dffts%nl(1:npw0)) = ks_wfcs(1:npw0,hw,isv)
130 psic(dffts%nlm(1:npw0)) = CONJG( ks_wfcs(1:npw0,hw,isv) )
159 psic(dffts%nl(1:npw0)) = ks_wfcs(1:npw0,hw,isv) + &
164 psic(dffts%nl(1:npw0)) = ks_wfcs(1:npw0,hw,isv)
165 psic(dffts%nlm(1:npw0)) = CONJG( ks_wfcs(1:npw0,hw,isv) )
198 psic(dffts%nl(1:npw0)) = ks_wfcs(1:npw0,ks,isv)
[all …]
|
| H A D | rotate_wannier.f90 | 45 INTEGER :: npw0 local
56 CALL gk_sort(xk(1,1),ngm,g,gcutw,npw0,igk0,g2kin_bp)
65 do ig=1,npw0
87 evc(1:npw0,1:nbnd)=evc1(1:npw0,1:nbnd)
|
| H A D | wannier_uterms.f90 | 55 INTEGER :: npw0 local
84 CALL gk_sort(xk(1,1),ngm,g,gcutw,npw0,igk0,g2kin_bp)
|
| /dports/science/quantum-espresso/q-e-qe-6.7.0/PW/src/ |
| H A D | h_epsi_her_set.f90 | 83 INTEGER :: npw0 local
337 npw0 = ngk(ikk)
466 DO ig = 1, npw0
551 npw0 = ngk(ikk)
776 DO ig = 1, npw0
898 npw0 = ngk(ikk)
948 DO ig=1,npw0
1049 DO ig = 1, npw0
1139 npw0 = ngk(ikk)
1350 DO ig = 1, npw0
[all …]
|
| H A D | forces_bp_efield.f90 | 124 INTEGER :: npw0 local
416 npw0 = ngk(ik)
422 CALL init_us_2( npw0, igk0, xk(1,nx_el(kpoint-1,pdir)), vkb )
423 CALL calbec( npw0, vkb, psi, becp0 )
426 DO ig = 1, npw0
432 CALL ZGEMM( 'C', 'N', nkb, nbnd*npol, npw0, ( 1.D0, 0.D0 ), &
505 DO ig = 1, npw0
510 DO ig = 1, npw0
621 DO ig = 1, npw0
626 DO ig = 1, npw0
|
| H A D | bp_c_phase.f90 | 232 INTEGER :: npw0 local
476 npw0 = ngk(kpoint-1)
480 CALL init_us_2 (npw0,igk0,xk(1,kpoint-1),vkb)
481 CALL calbec (npw0, vkb, psi, becp0)
612 DO ig=1,npw0
616 DO ig=1,npw0
|
| H A D | c_phase_field.f90 | 96 INTEGER :: npw0 local
403 npw0 = ngk(ik)
407 CALL init_us_2( npw0,igk0,xk(1,nx_el(kpoint-1,pdir)),vkb )
408 CALL calbec( npw0, vkb, psi, becp0)
524 DO ig=1,npw0
|