| /dports/science/xcrysden/xcrysden-1.6.2/F/ |
| H A D | pw_util.f | 5 integer ibrav local
46 SUBROUTINE set_convvec(ibrav, celldm, pv, cv) argument
58 integer ibrav, i, j local
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| H A D | latgen.f90 | 34 SUBROUTINE latgen(ibrav,celldm,a1,a2,a3,omega) argument
62 INTEGER, INTENT(in) :: ibrav local
405 SUBROUTINE abc2celldm ( ibrav, a,b,c,cosab,cosac,cosbc, celldm ) argument
414 INTEGER, INTENT (in) :: ibrav local
469 SUBROUTINE at2celldm (ibrav,a1,a2,a3,celldm) argument
480 INTEGER, INTENT(in) :: ibrav local
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| H A D | pwi2xsf_old.f | 148 subroutine pwLatgen( ibrav, celldm, p1, p2, p3, c1, c2, c3 ) argument
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| /dports/science/quantum-espresso/q-e-qe-6.7.0/Modules/ |
| H A D | latgen.f90 | 10 SUBROUTINE latgen_lib(ibrav,celldm,a1,a2,a3,omega, ierr, errormsg) argument
38 INTEGER, INTENT(in) :: ibrav local
387 SUBROUTINE at2celldm (ibrav,alat,a1,a2,a3,celldm) argument
398 INTEGER, INTENT(in) :: ibrav local
499 INTEGER :: ibrav local
635 INTEGER, INTENT (in) :: ibrav local
695 INTEGER, INTENT (in) :: ibrav local
736 SUBROUTINE remake_cell(ibrav, alat, a1,a2,a3) argument
740 INTEGER,INTENT(in) :: ibrav local
790 SUBROUTINE latgen(ibrav,celldm,a1,a2,a3,omega) argument
[all …]
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| H A D | wyckoff.f90 | 19 uniqueb,rhombohedral,choice,ibrav) argument
23 INTEGER, INTENT(OUT) :: ibrav local
105 SUBROUTINE ccord(outco,sym_n,not_eq,ibrav,unique) argument
108 INTEGER, INTENT(in) :: ibrav,sym_n,not_eq local
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| H A D | plot_io.f90 | 11 nr3, nat, ntyp, ibrav, celldm, at, gcutm, dual, ecut, plot_num, atm, & argument
27 integer :: nr1x, nr2x, nr3x, nr1, nr2, nr3, nat, ntyp, ibrav, & local
93 nat, ntyp, ibrav, celldm, at, gcutm, dual, ecut, plot_num) argument
104 integer :: nr1x, nr2x, nr3x, nr1, nr2, nr3, nat, ntyp, ibrav, plot_num, i local
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| H A D | bz_form.f90 | 45 INTEGER :: ibrav ! the bravais lattice index component
60 SUBROUTINE allocate_bz(ibrav, ibz, bz_struc, celldm, at, bg ) argument
62 INTEGER, INTENT(IN) :: ibz, ibrav local
1680 SUBROUTINE find_bz_type(ibrav, celldm, ibz) argument
1690 INTEGER, INTENT(IN) :: ibrav local
2123 SUBROUTINE transform_label_coord(ibrav, celldm, xk, letter, label_list, & argument
2136 INTEGER, INTENT(IN) :: ibrav local
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| /dports/science/quantum-espresso/q-e-qe-6.7.0/PW/tools/ |
| H A D | ibrav2cell.f90 | 16 INTEGER :: ibrav variable
22 NAMELIST /system/ ibrav, celldm, angle local
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| H A D | cell2ibrav.f90 | 15 INTEGER :: ibrav, ios variable
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| H A D | pwi2xsf.f90 | 49 & ibrav, &! label for Bravais lattice variable
91 & ibrav, nat, celldm, a, b, c, cosab, cosac, cosbc, & local
380 & ( ibrav, celldm, p1, p2, p3, c1, c2, c3 ) argument
400 & ibrav ! input: the index of the Bravais lattice local
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| H A D | scan_ibrav.f90 | 22 INTEGER :: ibrav, ios, ii, i, info variable
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| H A D | kpoints.f90 | 26 integer :: k(3,nptx), kw(nptx), ieq(nptx), i,j,l, n1,n2,n3, ibrav variable
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| /dports/science/vipster/vipster-1.19.1b-14-g7168a1b/vipster/ |
| H A D | crystal.cpp | 6 Mat Vipster::makeBravais(int ibrav, Vec axes, Vec angles) in makeBravais()
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| /dports/science/quantum-espresso/q-e-qe-6.7.0/PP/src/ |
| H A D | write_io_header.f90 | 10 nr1, nr2, nr3, nat, ntyp, ibrav, celldm, at, gcutm, dual, ecutwfc, & argument
22 INTEGER :: nr1x, nr2x, nr3x, nr1, nr2, nr3, nat, ntyp, ibrav local
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| /dports/science/quantum-espresso/q-e-qe-6.7.0/CPV/src/ |
| H A D | wannier.f90 | 195 SUBROUTINE wannier_startup( ibrav, alat, a1, a2, a3, b1, b2, b3 ) argument
207 INTEGER :: ibrav local
298 eigrb, taub, irb, ibrav, b1, b2, b3 ) argument
313 INTEGER :: ibrav local
390 taub, irb, ibrav, b1, b2, b3, rhor, drhor, rhog, & argument
411 INTEGER :: ibrav local
669 irb, ibrav, b1, b2, b3, taus, tausm, vels, & argument
695 INTEGER :: ibrav local
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| H A D | wf.f90 | 17 b1, b2, b3, Uall, what1, wfc, jw, ibrav ) argument
57 INTEGER, INTENT(IN) :: irb(3,nat), jw, ibrav, clwf local
999 SUBROUTINE wfunc_init( clwf, b1, b2, b3, ibrav ) argument
1019 INTEGER, INTENT(in) :: clwf, ibrav local
1343 SUBROUTINE setwfg( ibrav, b1, b2, b3 ) argument
1356 INTEGER, INTENT(IN) :: ibrav local
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| /dports/net-p2p/go-ethereum/go-ethereum-1.10.14/vendor/github.com/aws/aws-sdk-go-v2/service/codebuild/ |
| H A D | api_op_StopBuildBatch.go | 14 // Stops a running batch build.
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| /dports/science/quantum-espresso/q-e-qe-6.7.0/PHonon/PH/ |
| H A D | io_dyn_mat_old.f90 | 87 ntyp, nat, ibrav, celldm, at, atm, amass ) argument
101 INTEGER :: nqs, ntyp, nat, ibrav local
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| H A D | io_dyn_mat.f90 | 36 SUBROUTINE write_dyn_mat_header( fildyn, ntyp, nat, ibrav, nspin_mag, & argument
42 INTEGER, INTENT(IN) :: ntyp, nat, ibrav, nspin_mag, nqs local
288 SUBROUTINE read_dyn_mat_header(ntyp, nat, ibrav, nspin_mag, & argument
311 INTEGER, INTENT(out) :: ibrav local
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| H A D | dynmat.f90 | 99 integer :: ibrav, nqs variable
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| H A D | do_q2r.f90 | 50 INTEGER :: gid, ibrav, ierr, nspin_mag, ios local
557 subroutine set_zasr ( zasr, nr1,nr2,nr3, nat, ibrav, tau, zeu) argument
566 integer ibrav,nr1,nr2,nr3,nr,m,p,k,l,q,r local
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| H A D | matdyn.f90 | 164 INTEGER :: nr1, nr2, nr3, nsc, nk1, nk2, nk3, ibrav variable
823 ibrav, alat, at, ntyp, amass, omega, has_zstar ) argument
837 INTEGER :: ibrav, nr1,nr2,nr3,nat, ntyp local
1148 SUBROUTINE set_asr (asr, nr1, nr2, nr3, frc, zeu, nat, ibrav, tau) argument
1156 INTEGER, intent(in) :: nr1, nr2, nr3, nat, ibrav local
2018 SUBROUTINE gen_qpoints (ibrav, at_, bg_, nat, tau, ityp, nk1, nk2, nk3, & argument
2030 INTEGER :: ibrav, nat, nk1, nk2, nk3, ityp(*) local
2068 (nat, nq, nr1, nr2, nr3, ibrav, at, bg, tau, alat, & argument
2085 INTEGER, INTENT(in) :: nat, nq, nr1, nr2, nr3, ibrav, ndos local
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| H A D | ep_matrix_element_wannier.f90 | 722 SUBROUTINE readmat_findq (iudyn, ibrav, celldm, nat, ntyp, ityp, omega, & argument
734 INTEGER :: iudyn, ibrav, nat, ntyp, ityp (nat) local
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| /dports/science/vipster/vipster-1.19.1b-14-g7168a1b/vipster/plugins/ |
| H A D | cpmdinput.cpp | 87 static Mat makeCell(int ibrav, double b, double c, in makeCell()
167 int ibrav{0}; in CPInpParser() local
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| /dports/science/py-ase/ase-3.22.0/ase/io/ |
| H A D | espresso.py | 1402 def cell_to_ibrav(cell, ibrav): argument
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