/dports/science/erkale-pseudopotentials/erkale-870e772f09631b3dbdd99a18e4f3d4786d684a01/src/emd/ |
H A D | emd_similarity.cpp | 50 sim+=std::pow(rad[ir],2*k+2)*a_ave*b_ave*wrad[ir]; in similarity_quadrature() 66 sim+=std::pow(rad[ir],2*k+2)*c*wrad[ir]; in similarity_quadrature() 87 mom(k+2)+=std::pow(rad[ir],k+2)*ave*wrad[ir]; in emd_moments() 119 std::vector<double> rad, wrad; in emd_overlap() local 120 radial_chebyshev(nrad,rad,wrad); in emd_overlap() 154 arma::vec amom=emd_moments(rad,wrad,angmesh,emd_a); in emd_overlap() 155 arma::vec bmom=emd_moments(rad,wrad,angmesh,emd_b); in emd_overlap() 225 sim+=std::pow(rad[ir],2*k+2)*proddens[ir]*wrad[ir]; in similarity_quadrature_semi() 236 std::vector<double> rad, wrad; in emd_overlap_semi() local 237 radial_chebyshev(nrad,rad,wrad); in emd_overlap_semi() [all …]
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/dports/science/erkale/erkale-8297aefe5aac9dbbb291e04c07661f3cff94a99a/src/emd/ |
H A D | emd_similarity.cpp | 50 sim+=std::pow(rad[ir],2*k+2)*a_ave*b_ave*wrad[ir]; in similarity_quadrature() 66 sim+=std::pow(rad[ir],2*k+2)*c*wrad[ir]; in similarity_quadrature() 87 mom(k+2)+=std::pow(rad[ir],k+2)*ave*wrad[ir]; in emd_moments() 119 std::vector<double> rad, wrad; in emd_overlap() local 120 radial_chebyshev(nrad,rad,wrad); in emd_overlap() 154 arma::vec amom=emd_moments(rad,wrad,angmesh,emd_a); in emd_overlap() 155 arma::vec bmom=emd_moments(rad,wrad,angmesh,emd_b); in emd_overlap() 225 sim+=std::pow(rad[ir],2*k+2)*proddens[ir]*wrad[ir]; in similarity_quadrature_semi() 236 std::vector<double> rad, wrad; in emd_overlap_semi() local 237 radial_chebyshev(nrad,rad,wrad); in emd_overlap_semi() [all …]
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/dports/science/helfem/HelFEM-21461e9/src/diatomic/ |
H A D | twodquadrature.cpp | 47 wrad.zeros(1); in compute_bf() 48 wrad(0)=basp->get_wrad(iel)(irad); in compute_bf() 60 wtot.zeros(wrad.n_elem*wang.n_elem); in compute_bf() 63 size_t idx=ia*wrad.n_elem+ir; in compute_bf() 83 bf.cols(ia*wrad.n_elem,(ia+1)*wrad.n_elem-1)=arma::trans(abf); in compute_bf() 94 size_t idx=ia*wrad.n_elem+ir; in model_potential() 120 size_t idx=ia*wrad.n_elem+ir; in gto() 130 size_t idx=ia*wrad.n_elem+ir; in gto() 140 size_t idx=ia*wrad.n_elem+ir; in gto() 160 size_t idx=ia*wrad.n_elem+ir; in sto() [all …]
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H A D | dftgrid.cpp | 713 arma::vec wrad(1), r(1); in compute_bf() local 714 wrad(0)=basp->get_wrad(iel)(irad); in compute_bf() 727 scale_r.resize(wrad.n_elem*wang.n_elem); in compute_bf() 729 for(size_t ir=0;ir<wrad.n_elem;ir++) in compute_bf() 737 for(size_t ir=0;ir<wrad.n_elem;ir++) in compute_bf() 740 wtot.zeros(wrad.n_elem*wang.n_elem); in compute_bf() 743 size_t idx=ia*wrad.n_elem+ir; in compute_bf() 763 bf.cols(ia*wrad.n_elem,(ia+1)*wrad.n_elem-1)=arma::trans(abf); in compute_bf() 784 bf_rho.cols(ia*wrad.n_elem,(ia+1)*wrad.n_elem-1)=arma::trans(dr); in compute_bf() 785 bf_theta.cols(ia*wrad.n_elem,(ia+1)*wrad.n_elem-1)=arma::trans(dth); in compute_bf() [all …]
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H A D | twodquadrature.h | 47 arma::rowvec wrad; variable
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/dports/science/erkale/erkale-8297aefe5aac9dbbb291e04c07661f3cff94a99a/src/ |
H A D | chebyshev.cpp | 55 void radial_chebyshev(int nrad, std::vector<double> & rad, std::vector<double> & wrad) { in radial_chebyshev() argument 62 wrad.clear(); in radial_chebyshev() 76 wrad.push_back(w); in radial_chebyshev() 81 void radial_chebyshev_jac(int nrad, std::vector<double> & rad, std::vector<double> & wrad) { in radial_chebyshev_jac() argument 88 wrad.clear(); in radial_chebyshev_jac() 89 wrad.reserve(wc.size()); in radial_chebyshev_jac() 95 wrad.push_back(w); in radial_chebyshev_jac()
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H A D | badergrid.cpp | 78 std::vector<double> rad, wrad; in construct_bader() local 79 radial_chebyshev_jac(nr,rad,wrad); in construct_bader() 86 sh.w=wrad[irad]; in construct_bader() 258 std::vector<double> rad, wrad; in construct_voronoi() local 259 radial_chebyshev_jac(nr,rad,wrad); in construct_voronoi() 266 sh.w=wrad[irad]; in construct_voronoi()
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H A D | lmgrid.cpp | 35 std::vector<double> rad, wrad; in form_radial_grid() local 36 radial_chebyshev(nrad,rad,wrad); in form_radial_grid() 46 ret[ir].w=wrad[ir]*ret[ir].r*ret[ir].r; in form_radial_grid()
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H A D | dftgrid.cpp | 129 const double wrad(info.w); in lobatto_shell() local 213 const double wrad(info.w); in lebedev_shell() local 233 point.w=wrad*points[i].w; in lebedev_shell() 3278 std::vector<double> rad, wrad; in construct() local 3297 sh.w=wrad[irad]; in construct() 3358 std::vector<double> rad, wrad; in construct() local 3366 sh.w=wrad[irad]; in construct() 3433 sh.w=wrad[irad]; in construct() 3499 sh.w=wrad[irad]; in construct() 3627 sh.w=wrad[irad]; in construct_becke() [all …]
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/dports/science/erkale-pseudopotentials/erkale-870e772f09631b3dbdd99a18e4f3d4786d684a01/src/ |
H A D | chebyshev.cpp | 55 void radial_chebyshev(int nrad, std::vector<double> & rad, std::vector<double> & wrad) { in radial_chebyshev() argument 62 wrad.clear(); in radial_chebyshev() 76 wrad.push_back(w); in radial_chebyshev() 81 void radial_chebyshev_jac(int nrad, std::vector<double> & rad, std::vector<double> & wrad) { in radial_chebyshev_jac() argument 88 wrad.clear(); in radial_chebyshev_jac() 89 wrad.reserve(wc.size()); in radial_chebyshev_jac() 95 wrad.push_back(w); in radial_chebyshev_jac()
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H A D | badergrid.cpp | 78 std::vector<double> rad, wrad; in construct_bader() local 79 radial_chebyshev_jac(nr,rad,wrad); in construct_bader() 86 sh.w=wrad[irad]; in construct_bader() 258 std::vector<double> rad, wrad; in construct_voronoi() local 259 radial_chebyshev_jac(nr,rad,wrad); in construct_voronoi() 266 sh.w=wrad[irad]; in construct_voronoi()
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H A D | lmgrid.cpp | 35 std::vector<double> rad, wrad; in form_radial_grid() local 36 radial_chebyshev(nrad,rad,wrad); in form_radial_grid() 46 ret[ir].w=wrad[ir]*ret[ir].r*ret[ir].r; in form_radial_grid()
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H A D | dftgrid.cpp | 129 const double wrad(info.w); in lobatto_shell() local 213 const double wrad(info.w); in lebedev_shell() local 233 point.w=wrad*points[i].w; in lebedev_shell() 3278 std::vector<double> rad, wrad; in construct() local 3297 sh.w=wrad[irad]; in construct() 3358 std::vector<double> rad, wrad; in construct() local 3366 sh.w=wrad[irad]; in construct() 3433 sh.w=wrad[irad]; in construct() 3499 sh.w=wrad[irad]; in construct() 3627 sh.w=wrad[irad]; in construct_becke() [all …]
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/dports/science/helfem/HelFEM-21461e9/src/atomic/ |
H A D | dftgrid.cpp | 678 arma::vec wrad(basp->get_wrad(iel)); in compute_bf() local 686 scale_r.ones(wrad.n_elem*wang.n_elem); in compute_bf() 690 for(size_t ir=0;ir<wrad.n_elem;ir++) in compute_bf() 695 for(size_t ir=0;ir<wrad.n_elem;ir++) in compute_bf() 699 wtot.zeros(wrad.n_elem*wang.n_elem); in compute_bf() 701 for(size_t ir=0;ir<wrad.n_elem;ir++) { in compute_bf() 702 size_t idx=ia*wrad.n_elem+ir; in compute_bf() 719 bf.cols(ia*wrad.n_elem,(ia+1)*wrad.n_elem-1)=arma::trans(abf); in compute_bf() 737 bf_rho.cols(ia*wrad.n_elem,(ia+1)*wrad.n_elem-1)=arma::trans(dr); in compute_bf() 738 bf_theta.cols(ia*wrad.n_elem,(ia+1)*wrad.n_elem-1)=arma::trans(dth); in compute_bf() [all …]
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/dports/science/helfem/HelFEM-21461e9/src/sadatom/ |
H A D | dftgrid.cpp | 487 arma::vec wrad(basp->get_wrad(iel)); in compute_bf() local 490 wtot.zeros(wrad.n_elem); in compute_bf() 491 for(size_t ir=0;ir<wrad.n_elem;ir++) { in compute_bf() 492 wtot(ir)=4.0*M_PI*wrad(ir)*std::pow(r(ir),2); in compute_bf()
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/dports/science/erkale-pseudopotentials/erkale-870e772f09631b3dbdd99a18e4f3d4786d684a01/src/casida/ |
H A D | casida_grid.cpp | 258 std::vector<double> rad, wrad; in construct() local 259 radial_chebyshev(nr,rad,wrad); in construct() 266 sh.w=wrad[irad]*sh.R*sh.R; in construct()
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/dports/science/erkale/erkale-8297aefe5aac9dbbb291e04c07661f3cff94a99a/src/casida/ |
H A D | casida_grid.cpp | 258 std::vector<double> rad, wrad; in construct() local 259 radial_chebyshev(nr,rad,wrad); in construct() 266 sh.w=wrad[irad]*sh.R*sh.R; in construct()
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/dports/graphics/grads/grads-1.9b4/src/ |
H A D | gagx.c | 1338 float x,y,spd,dir,roff,scl,rad,t,digsiz,msize,plen,wrad; in gasmdl() local 1365 wrad = msize*0.5; in gasmdl() 1575 wrad = orad; in gasmdl() 1577 gabarb (x, y, plen, pcm->digsiz*2.5, wrad, dir, spd, hemflg); in gasmdl()
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/dports/editors/texstudio/texstudio-4.1.2/utilities/dictionaries/ |
H A D | tk_TK-Turkmen.dic | 48610 töwrad/28
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/dports/chinese/ibus-table-chinese/ibus-table-chinese-1.8.3/tables/wubi-haifeng/ |
H A D | Word.tab | 26086 保质期 wrdw wrad 892000 336000 1228000 0 3
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H A D | wubi-haifeng86.UTF-8 | 133715 wrad 保质期 1238000
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/dports/chinese/brise/brise-brise-0.35/supplement/ |
H A D | wubi86.dict.yaml | 122811 保质期 wrad 3430000
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/dports/chinese/rime-wubi/rime-wubi-f1876f08f1d4a9696395be0070c0e8e4353c44cb/ |
H A D | wubi86.dict.yaml | 122740 保质期 wrad 3430000
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