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Searched defs:ucell (Results 1 – 25 of 102) sorted by relevance

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/dports/science/siesta/siesta-4.1.5/Src/
H A Dksvinit.F22 subroutine estimate_pol_kpoints(ucell) argument
27 real(dp), intent(in) :: ucell(3,3) local
50 subroutine KSV_init( ucell, maxkpol ) argument
H A Dkpoint_convert.f9011 subroutine kpoint_convert(ucell,kin,kout,iopt) argument
35 real(dp), dimension(3,3), intent(in) :: ucell local
H A Dm_supercell.F9026 subroutine exact_sc_ag(negl,ucell,na_u,isa,xa,nsc) argument
42 real(dp), intent(in) :: ucell(3,3) local
H A Dts_init.F9019 subroutine ts_init(nspin, ucell, na_u, xa, lasto, no_u, inicoor, fincoor ) argument
57 real(dp), intent(in) :: ucell(3,3) local
H A Dredcel.F8 subroutine redcel( alat, ucell, scell, mscell ) argument
H A Dobc.f8 subroutine obc( polR, ucell, dx, nspin) argument
H A Dautomatic_cell.f8 subroutine automatic_cell(ucell,scell,na_u,xa,isa,charnet) argument
18 real(dp), dimension(3,3), intent(out) :: ucell local
H A Dremove_intramol_pressure.f9010 subroutine remove_intramol_pressure(ucell,stress,na_u,xa,fa,mstress) argument
20 real(dp), intent(in) :: ucell(3,3), xa(3,na_u), fa(3,na_u) local
H A Dm_hartree_add.F90114 subroutine init_hartree_add(ucell, mesh) argument
122 real(dp), intent(in) :: ucell(3,3) local
318 subroutine hartree_add(ucell,npt_l,Vscf) argument
327 real(dp), intent(in) :: ucell(3,3) local
H A Dts_show_regions.f908 subroutine ts_show_regions(ucell,na_u,xa,N_Elec,Elecs) argument
23 real(dp), intent(in) :: ucell(3,3) local
H A Dksv.f11 subroutine KSV_pol( nua, na, xa, rmaxo, scell, ucell, nuotot, argument
H A Doptical.F8 subroutine optical( nua, na, xa, scell, ucell, nuotot, nuo, no, argument
H A Dkpoint_grid.F9042 subroutine setup_Kpoint_grid( ucell ) argument
49 real(dp) :: ucell(3,3) local
H A Dm_charge_add.F90128 subroutine init_charge_add(ucell, mesh) argument
136 real(dp), intent(in) :: ucell(3,3) local
373 subroutine charge_add(sign,ucell,npt_l,DRho) argument
384 real(dp), intent(in) :: ucell(3,3) local
H A Dcreate_Sparsity_SC.F9031 TM,ucell,lasto,xa,xij,isc_off) ! 3. option argument
57 real(dp), intent(in), optional :: ucell(3,3) local
198 UC,TM,ucell,lasto,xa,xij, & argument
223 real(dp), intent(in), optional :: ucell(3,3) local
348 TM,ucell,lasto,xa,xij,& argument
362 real(dp), intent(in) :: ucell(3,3) local
H A Dkpoint_pdos.F9042 subroutine setup_Kpoint_pdos( ucell, different_pdos_grid ) argument
49 real(dp), intent(in) :: ucell(3,3) local
H A Dmetaforce.F87 subroutine meta(xa,na,ucell,Emeta,fa,stress,forces,stresses) argument
/dports/editors/neovim/neovim-0.6.1/src/nvim/
H A Dugrid.h12 struct ucell { struct
13 char data[CELLBYTES + 1];
14 sattr_T attr;
/dports/textproc/fox-xml/fox-4.1.2-91-g9c6716e/wcml/test/
H A Dtest_cmlAddLattice_2.f909 double precision, dimension(3,3) :: ucell variable
H A Dtest_cmlAddLattice_1.f909 real, dimension(3,3) :: ucell variable
/dports/science/py-abipy/abipy-0.9.0/abipy/data/
H A Ducells.py18 def ucell(name): function
/dports/science/siesta/siesta-4.1.5/Util/TS/TBtrans/
H A Dm_tbt_gf.F9030 ucell,nkpnt,kpoint,kweight, & argument
56 real(dp), dimension(3,3) :: ucell ! The unit cell of the CONTACT local
/dports/science/py-phonopy/phonopy-2.11.0/phonopy/structure/
H A Dsymmetry.py378 def elaborate_borns_and_epsilon(ucell, argument
438 ucell, argument
571 def _extract_independent_atoms(ucell, argument
588 def _get_supercell_and_primitive(ucell, argument
/dports/science/phonopy/phonopy-2.11.0/phonopy/structure/
H A Dsymmetry.py378 def elaborate_borns_and_epsilon(ucell, argument
438 ucell, argument
571 def _extract_independent_atoms(ucell, argument
588 def _get_supercell_and_primitive(ucell, argument
/dports/games/knetwalk/knetwalk-21.12.3/src/
H A Dabstractgrid.cpp280 int ucell = uCell(cell); // up in addRandomCable() local
480 int ucell = uCell(cell->index()); in movesDoneArePossible() local
562 AbstractCell *ucell = (uindex != NO_CELL) ? m_cells[uindex] : 0; in updateConnections() local

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