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Searched refs:nncell (Results 1 – 14 of 14) sorted by relevance

/dports/deskutils/treesheets/treesheets-1.0.2/lobster/src/lobster/
H A Dwfc.h172 auto &nncell = cells[pnn.y][pnn.x]; in WaveFunctionCollapse() local
173 if (nncell.state != State::CLOSED) { in WaveFunctionCollapse()
181 nncell.wf &= superopts; in WaveFunctionCollapse()
182 nncell.popcnt = PopCount(nncell.wf); in WaveFunctionCollapse()
184 totalnnumopts += nncell.popcnt; in WaveFunctionCollapse()
/dports/science/wannier90/wannier90-3.1.0/src/
H A Dkmesh.F90303 nncell(1, nkp, nnx) = l
304 nncell(2, nkp, nnx) = m
305 nncell(3, nkp, nnx) = n
340 nncell(1, nkp, bnum) = l
341 nncell(2, nkp, bnum) = m
342 nncell(3, nkp, bnum) = n
521 nncell_tmp(:, :, :) = nncell(:, :, :)
525 deallocate (nncell, stat=ierr)
560 nncell(1, 1, na) = nncell_tmp(1, 1, nn)
792 if (allocated(nncell)) then
[all …]
H A Doverlap.F9095 use w90_parameters, only: num_bands, num_wann, num_kpts, nntot, nncell, nnlist, &
171 (nnl .eq. nncell(1, nkp, inn)) .and. &
172 (nnm .eq. nncell(2, nkp, inn)) .and. &
173 (nnn .eq. nncell(3, nkp, inn))) then
H A Dwannier_lib.F90179 nncell_loc(:, :, 1:nntot) = nncell(:, :, 1:nntot)
H A Dparameters.F90438 integer, public, save, allocatable :: nncell(:, :, :) ! gives BZ of each neighbour of each k-point variable
2116 if (allocated(nncell)) deallocate (nncell)
2117 allocate (nncell(3, num_kpts, nntot), stat=ierr)
2122 nncell(:, k, nnkpts_idx(k)) = nnkpts_block(3:, i)
6407 allocate (nncell(3, num_kpts, nntot), stat=ierr)
6423 call comms_bcast(nncell(1, 1, 1), 3*num_kpts*nntot)
/dports/science/elk/elk-7.2.42/src/
H A Dwritew90mmn.f9042 vl(:)=dble(nncell(:,ik,i))+vkl(:,jk)-vkl(:,ik)
60 write(50,'(5I8)') ik,jk,nncell(:,ik,i)
H A Dsetupw90.f9043 nncell,num_bands,num_wann,proj_site,proj_l,proj_m,proj_radial,proj_z,proj_x, &
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dqs_wannier90.F169 INTEGER, ALLOCATABLE, DIMENSION(:, :, :) :: nncell local
286 ALLOCATE (nncell(3, num_kpts, num_nnmax))
288 nncell = 0
294 kpt_latt, nntot, nnlist, nncell, iw)
300 CALL mp_sum(nncell, para_env%group)
406 bvec(1:3) = kpt_latt(1:3, nnlist(ik, i)) - kpt_latt(1:3, ik) + nncell(1:3, ik, i)
538 WRITE (iunit, "(2I8,3I5)") ik, ik2, nncell(1:3, ik, i)
617 DEALLOCATE (nnlist, nncell)
H A Dwannier90.F100 INTEGER, ALLOCATABLE :: nncell(:, :, :) ! gives BZ of each neighbour of each k-point variable
193 nncell_loc(:, :, 1:nntot) = nncell(:, :, 1:nntot)
196 DEALLOCATE (nncell, neigh, nnlist)
448 ALLOCATE (nncell(3, num_kpts, nntot))
491 nncell(1, nkp, nnx) = l
492 nncell(2, nkp, nnx) = m
493 nncell(3, nkp, nnx) = n
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dqs_wannier90.F169 INTEGER, ALLOCATABLE, DIMENSION(:, :, :) :: nncell local
286 ALLOCATE (nncell(3, num_kpts, num_nnmax))
288 nncell = 0
294 kpt_latt, nntot, nnlist, nncell, iw)
300 CALL mp_sum(nncell, para_env%group)
406 bvec(1:3) = kpt_latt(1:3, nnlist(ik, i)) - kpt_latt(1:3, ik) + nncell(1:3, ik, i)
538 WRITE (iunit, "(2I8,3I5)") ik, ik2, nncell(1:3, ik, i)
617 DEALLOCATE (nnlist, nncell)
H A Dwannier90.F100 INTEGER, ALLOCATABLE :: nncell(:, :, :) ! gives BZ of each neighbour of each k-point variable
193 nncell_loc(:, :, 1:nntot) = nncell(:, :, 1:nntot)
196 DEALLOCATE (nncell, neigh, nnlist)
448 ALLOCATE (nncell(3, num_kpts, nntot))
491 nncell(1, nkp, nnx) = l
492 nncell(2, nkp, nnx) = m
493 nncell(3, nkp, nnx) = n
/dports/science/wannier90/wannier90-3.1.0/src/postw90/
H A Dget_oper.F90260 transl_inv, nncell, effective_model
408 (nnl .eq. nncell(1, ik, inn)) .and. &
409 (nnm .eq. nncell(2, ik, inn)) .and. &
410 (nnn .eq. nncell(3, ik, inn))) then
510 timing_level, nncell, scissors_shift
592 (nnl .eq. nncell(1, ik, inn)) .and. &
593 (nnm .eq. nncell(2, ik, inn)) .and. &
594 (nnn .eq. nncell(3, ik, inn))) then
1108 transl_inv, nncell, spn_formatted, eigval, &
1346 (nnl .eq. nncell(1, ik, inn)) .and. &
[all …]
H A Dpostw90_common.F90449 allocate (nncell(3, num_kpts, nntot), stat=ierr)
465 call comms_bcast(nncell(1, 1, 1), 3*num_kpts*nntot)
/dports/science/wannier90/wannier90-3.1.0/doc/user_guide/
H A Dwannier.tex40 \verb# gamma_only,spinors,nntot,nnlist,nncell,num_bands,num_wann,proj_site,#\\
83 \verb# intent(out) :: nncell#\\
262 \verb#nncell(1:3,nkp,nn)#