/dports/science/quantum-espresso/q-e-qe-6.7.0/Modules/ |
H A D | volume.f90 | 10 SUBROUTINE volume (alat, a1, a2, a3, omega) argument 21 REAL(dp), INTENT(IN) :: alat, a1(3), a2(3), a3(3) local
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H A D | xsf.f90 | 14 SUBROUTINE xsf_struct (alat, at, nat, tau, atm, ityp, ounit) argument 20 real(DP) :: alat, tau (3, nat), at (3, 3) local 54 (rho, nr1, nr2, nr3, nr1x, nr2x, nr3x, at, alat, ounit) argument 59 real(DP) :: alat, at (3, 3), rho(nr1x,nr2x,nr3x) local 118 SUBROUTINE xsf_datagrid_2d (rho, nx, ny, m1, m2, x0, e1, e2, alat, ounit) argument 123 real(DP) :: m1, m2, alat, x0(3), e1(3), e2(3), rho(2, nx, ny) local 164 (rho, nx, ny, nz, m1, m2, m3, x0, e1, e2, e3, alat, ounit) argument 169 real(DP) :: m1, m2, m3, alat, x0(3), e1(3),e2(3),e3(3), rho(nx, ny, nz) local
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H A D | mm_dispersion.f90 | 337 REAL ( DP ) , INTENT ( IN ) :: alat , tau (3, nat) , & local 441 REAL ( DP ) , INTENT ( IN ) :: alat , tau (3, nat) , & local 559 REAL ( DP ) , INTENT ( IN ) :: alat , tau (3, nat) , omega , & local
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/dports/science/quantum-espresso/q-e-qe-6.7.0/CPV/src/ |
H A D | smallbox.f90 | 36 SUBROUTINE small_box_set( alat, omega, at, rat1, rat2, rat3, tprint ) argument 40 REAL(DP), INTENT(IN) :: alat, omega, at(3,3), rat1, rat2, rat3 local
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H A D | smallbox_lib.f90 | 9 SUBROUTINE initbox ( tau0, alat, at, ainv, taub, irb ) argument 25 REAL(DP), INTENT(in) :: tau0(3,nat), at(3,3), ainv(3,3), alat local
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/dports/science/quantum-espresso/q-e-qe-6.7.0/FFTXlib/ |
H A D | gen_test_params.py | 28 alat = match_alat.findall(data) variable 34 alat = alat[0][0]; nbnd=nbnd[0][0]; ewfc=ewfc[0][0];erho=erho[0][0] variable
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/dports/science/quantum-espresso/q-e-qe-6.7.0/PW/src/ |
H A D | read_conf_from_file.f90 | 10 SUBROUTINE read_conf_from_file( stop_on_error, nat, nsp, tau, alat, at ) argument 30 REAL(DP),INTENT(out) :: alat local
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H A D | force_lc.f90 | 10 SUBROUTINE force_lc( nat, tau, ityp, alat, omega, ngm, ngl, & argument 51 REAL(DP), INTENT(IN) :: alat local
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H A D | symmetrize_at.f90 | 9 SUBROUTINE symmetrize_at( nsym, s, invs, ft, irt, nat, tau, at, bg, alat, omega ) argument 37 REAL(DP), INTENT(INOUT) :: alat local
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/dports/comms/wsjtz/wsjtx/map65/libm65/ |
H A D | geocentric.f90 | 1 subroutine geocentric(alat,elev,hlt,erad) argument
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/dports/science/siesta/siesta-4.1.5/Src/ |
H A D | redcel.F | 8 subroutine redcel( alat, ucell, scell, mscell ) argument
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H A D | get_kpoints_scale.f90 | 25 real(dp) :: alat local
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/dports/science/quantum-espresso/q-e-qe-6.7.0/PW/tools/ |
H A D | cell2ibrav.f90 | 18 REAL(DP) :: a(3,3), omega, e(3,3), alat variable
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/dports/science/siesta/siesta-4.1.5/Util/Vibra/Src/ |
H A D | recoor.f | 8 subroutine recoor(overflow, cell, alat, xa, isa, xmass, na) argument
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/dports/misc/libpredict/libpredict-2.0.0/tests/ |
H A D | testcase_reader.h | 23 double alat() const {return m_alat;}; in alat() function
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/dports/science/quantum-espresso/q-e-qe-6.7.0/PP/src/ |
H A D | chdens_bspline.f90 | 116 SUBROUTINE plot_1d_bspline (nptx, m1, x0, e, rhor, alat, iflag, ounit) argument 127 real(dp), intent(in) :: e(3), x0(3), m1, alat local 160 SUBROUTINE plot_2d_bspline (nx, ny, m1, m2, x0, e1, e2, rhor, alat, & argument 172 real(dp), intent(in) :: e1(3), e2(3), x0(3), m1, m2, alat, tau(3,nat), at(3,3) local 246 SUBROUTINE plot_3d_bspline (alat, at, nat, tau, atm, ityp, rhor, & argument 259 real(dp), intent(in) :: alat, tau(3,nat), at(3,3) local
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H A D | cube.f90 | 23 SUBROUTINE write_cubefile ( alat, at, bg, nat, tau, atm, ityp, rho, & argument 32 REAL(DP), INTENT(IN) :: alat, tau(3,nat), at(3,3),bg(3,3), rho(nr1x,nr2x,nr3x) local 95 SUBROUTINE write_cubefile_new (alat, nat, tau, atm, ityp, x0, & argument 102 real(dp), intent(in) :: alat, tau(3,nat) local
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H A D | add_shift_lc.f90 | 10 SUBROUTINE add_shift_lc (nat, tau, ityp, alat, omega, ngm, ngl, & argument 38 rho (nrxx, nspin), alat, omega local
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/dports/science/cdcl/dcl-5.4.8-C/demo/rakuraku/u2d/ |
H A D | u2d4.c | 42 static real alat[37], alon[37], slat; in MAIN__() local
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/dports/science/cdcl/dcl-5.4.8-C/demo/grph1/scpack/ |
H A D | scpkt7.c | 42 static real alat[37], alon[37]; in MAIN__() local
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H A D | scpkt8.c | 43 static real alat[37], alon[37]; in MAIN__() local
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/dports/science/cdcl/dcl-5.4.8-C/demo/grph2/udegpk/ |
H A D | u2df01.c | 45 static real alat, alon, slat; in MAIN__() local
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H A D | u2df04.c | 46 static real alat, alon, slat; in MAIN__() local
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/dports/science/cdcl/dcl-5.4.8-C/demo/rakuraku/quick/ |
H A D | quick4.c | 45 static real alat, alon, slat; in MAIN__() local
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H A D | quick3.c | 45 static real alat, alon, slat; in MAIN__() local
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