/dports/science/quantum-espresso/q-e-qe-6.7.0/CPV/src/ |
H A D | ions_nose.f90 | 40 INTEGER :: nhpcl=1, ndega, nhpdim=1, nhptyp=0, nhpbeg=0, nhpend=0 variable 260 subroutine set_atmnhp(nhgrp,atm2nhp,nhpdim,nhpbeg) argument 265 integer, intent(out) :: nhpdim, nhpbeg, atm2nhp(:) local 419 subroutine ions_nosevel( vnhp, xnhp0, xnhpm, delt, nhpcl, nhpdim ) argument 421 integer, intent(in) :: nhpcl, nhpdim local 439 …upd( xnhpp, xnhp0, xnhpm, delt, qnp, ekin2nhp, gkbt2nhp, vnhp, kbt, nhpcl, nhpdim, nhpbeg, nhpend ) argument 441 integer, intent(in) :: nhpcl, nhpdim, nhpbeg, nhpend local 500 integer :: nhpcl, nhpdim local
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H A D | restart.f90 | 14 & lambda,lambdam,idesc,xnhe0,xnhem,vnhe,xnhp0,xnhpm,vnhp,nhpcl,nhpdim,ekincm,& argument 44 integer, INTENT(in) :: nhpcl, nhpdim local 114 & lambda,lambdam,xnhe0,xnhem,vnhe,xnhp0,xnhpm,vnhp,nhpcl,nhpdim,ekincm,& argument 144 integer, INTENT(inout) :: nhpcl,nhpdim local
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H A D | ions_positions.f90 | 129 fionm, vnhp, velsp, velsm, nhpcl, nhpdim, atm2nhp ) argument 138 INTEGER, INTENT(IN) :: ityp(:), nat, nhpcl, nhpdim, atm2nhp(:) local
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H A D | cp_restart_new.f90 | 42 vnhp, xnhp0, xnhpm, nhpcl, nhpdim, occ0, occm, & argument 124 INTEGER, INTENT(IN) :: nhpdim ! local 544 vnhp, xnhp0, xnhpm, nhpcl,nhpdim,occ0, occm, & argument 608 INTEGER, INTENT(INOUT) :: nhpdim ! local 829 acc, stau0, svel0, taui, cdmi, force, nhpcl, nhpdim, & argument 852 INTEGER, INTENT(IN) :: nhpdim local 1162 cdmi, force, nhpcl, nhpdim, xnhp0, vnhp, ekincm, xnhe0, vnhe, ht, & argument 1190 INTEGER, INTENT(inout) :: nhpdim local
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H A D | wannier.f90 | 671 vnhe, xnhp0, xnhpm, vnhp, nhpcl,nhpdim,ekincm,& argument 702 INTEGER :: nhpcl, nhpdim local
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H A D | cp_interfaces.f90 | 275 integer, INTENT(inout) :: nhpcl,nhpdim local 300 integer, INTENT(in) :: nhpcl, nhpdim local
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/dports/science/quantum-espresso/q-e-qe-6.7.0/Modules/ |
H A D | ions_base.f90 | 388 …subroutine ions_temp( tempp, temps, ekinpr, vels, nsp, na, nat, ityp, h, pmass, ndega, nhpdim, atm… argument 400 integer, intent(in) :: nsp, na(:), nat, ityp(:), ndega, nhpdim, atm2nhp(:) local
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