Home
last modified time | relevance | path

Searched refs:Nind (Results 1 – 25 of 35) sorted by relevance

12

/dports/science/qmcpack/qmcpack-3.11.0/src/formic/utils/lmyengine/
H A Dspam_solver.cpp630 const int Nind = _le_der.cols(); in HMatVecOp() local
742 formic::ColVec<double> temp2(Nind); in HMatVecOp()
794 formic::ColVec<double> temp2(Nind); in HMatVecOp()
831 int Nind = _le_der.cols(); in HMatMatOp() local
854 …formic::dgemm('N', 'N', Ns, Nnew, Nind, 1.0, &_le_der.at(0, 0), Ns, &x.at(0, 0), Nind, 0.0, &temp.… in HMatMatOp()
872 …formic::dgemm('T', 'N', Nind, Nnew, Ns, 1.0, &_le_der.at(0, 0), Ns, &temp.at(0, 0), Ns, 0.0, &y.at… in HMatMatOp()
964 const int Nind = _le_der.cols(); in SMatVecOp() local
1094 int Nind = _le_der.cols(); in SMatMatOp() local
1114 …formic::dgemm('N', 'N', Ns, Nnew, Nind, 1.0, &_der_rat.at(0, 0), Ns, &x.at(0, 0), Nind, 0.0, &temp… in SMatMatOp()
1117 …formic::dgemm('T', 'N', Nind, Nnew, Ns, 1.0, &_der_rat.at(0, 0), Ns, &temp.at(0, 0), Ns, 0.0, &y.a… in SMatMatOp()
[all …]
H A Ddavidson_solver.h661 const int Nind = this->_le_der.cols(); variable
678 …formic::xgemv('N', Ns, Nind, formic::unity(S()), &this->_le_der.at(0,0), Ns, &x.at(0), 1, formic::…
681 …formic::xgemv('T', Ns, Nind, formic::unity(S()), &this->_der_rat.at(0,0), Ns, &temp.at(0), 1, form…
698 …formic::xgemv('N', Ns, Nind, formic::unity(S()), &this->_le_der.at(0,0), Ns, &x.at(0), 1, formic::…
704 …formic::xgemv('T', Ns, Nind, formic::unity(S()), &this->_der_rat.at(0,0), Ns, &temp1.at(0), 1, for…
774 const int Nind = this->_le_der.cols(); variable
791 …formic::xgemv('N', Ns, Nind, formic::unity(S()), &this->_der_rat.at(0,0), Ns, &x.at(0), 1, formic:…
794 …formic::xgemv('T', Ns, Nind, formic::unity(S()), &this->_der_rat.at(0,0), Ns, &temp.at(0), 1, form…
811 …formic::xgemv('N', Ns, Nind, formic::unity(S())*this->_hd_shift, &this->_der_rat.at(0,0), Ns, &x.a…
814 …formic::xgemv('N', Ns, Nind, formic::unity(S()), &this->_le_der.at(0,0), Ns, &x.at(0), 1, formic::…
[all …]
/dports/science/afni/afni-AFNI_21.3.16/src/SUMA/
H A DSUMA_SurfNorm.c358 SUMA_MEMBER_FACE_SETS *SUMA_MemberFaceSets (int Nind, int * FaceSetList, in SUMA_MemberFaceSets() argument
370 SUMA_LHv("Nind=%d, nFr=%d, FaceDim=%d\n", Nind, nFr, FaceDim); in SUMA_MemberFaceSets()
388 tmpMember = (int **) SUMA_allocate2D (Nind, in SUMA_MemberFaceSets()
390 RetStrct->N_Memb = (int *) SUMA_calloc (Nind, sizeof(int)); in SUMA_MemberFaceSets()
391 filled = (byte *)SUMA_calloc(Nind, sizeof(int)); in SUMA_MemberFaceSets()
404 if (inode > Nind) { in SUMA_MemberFaceSets()
428 (int **) SUMA_allocate2D (Nind, RetStrct->N_Memb_max ,sizeof(int)); in SUMA_MemberFaceSets()
437 for (inode = 0; inode < Nind; ++inode) { in SUMA_MemberFaceSets()
449 if (tmpMember) SUMA_free2D((char **)tmpMember, Nind); in SUMA_MemberFaceSets()
452 RetStrct->Nnode = Nind; in SUMA_MemberFaceSets()
H A DSUMA_MakeColorMap.c152 int Ncols = 0, N_Fid = 0, kar, i, ifact, *Nind = NULL, in main() local
534 Nind = (int *) SUMA_calloc (N_Fid/4, sizeof(int)); in main()
535 if (Fid == NULL || !Nind) { in main()
545 Nind[i] = (int)far[i+3*im->nx]; in main()
551 SM = SUMA_MakeColorMap_v2 (Fid, N_Fid/4, 0, Nind, SkipLast, FuncName); in main()
716 if (Nind) SUMA_free(Nind); in main()
H A DSUMA_Color.c5498 int *Nind; in SUMA_MakeStandardMap() local
5694 Nind[k] = 0; ++k; in SUMA_MakeStandardMap()
5696 Nind[k] = 7; ++k; in SUMA_MakeStandardMap()
5719 SUMA_free(Nind); in SUMA_MakeStandardMap()
5743 Nind[k] = 0; ++k; in SUMA_MakeStandardMap()
5745 Nind[k] = 7; ++k; in SUMA_MakeStandardMap()
5768 SUMA_free(Nind); in SUMA_MakeStandardMap()
5792 Nind[k] = 0; ++k; in SUMA_MakeStandardMap()
5810 SUMA_free(Nind); in SUMA_MakeStandardMap()
5852 SUMA_free(Nind); in SUMA_MakeStandardMap()
[all …]
H A DSUMA_DOmanip.h38 SUMA_MEMBER_FACE_SETS *SUMA_MemberFaceSets (int Nind, int * FaceSetList, int nFr , int FaceDim, cha…
/dports/science/erkale-pseudopotentials/erkale-870e772f09631b3dbdd99a18e4f3d4786d684a01/src/
H A Derifit.cpp544 size_t Nind=0; in compute_ERIfit() local
547 Nind++; in compute_ERIfit()
549 Sval=Sval.subvec(Sval.n_elem-Nind,Sval.n_elem-1); in compute_ERIfit()
550 Svec=Svec.cols(Svec.n_cols-Nind,Svec.n_cols-1); in compute_ERIfit()
637 size_t Nind=0; in compute_diag_ERIfit() local
640 Nind++; in compute_diag_ERIfit()
642 Sval=Sval.subvec(Sval.n_elem-Nind,Sval.n_elem-1); in compute_diag_ERIfit()
643 Svec=Svec.cols(Svec.n_cols-Nind,Svec.n_cols-1); in compute_diag_ERIfit()
H A Dbasis.cpp2906 size_t Nind=0; in projectMOs() local
2909 Nind++; in projectMOs()
2912 if(Nind<nocc) { in projectMOs()
2935 E.zeros(Nind); in projectMOs()
2965 if(nocc<Nind) { in projectMOs()
2983 MOs.cols(nocc,Nind-1)=Cnew.cols(nocc,Nind-1); in projectMOs()
3040 size_t Nind=0; in projectOMOs() local
3043 Nind++; in projectOMOs()
3046 if(Nind<nocc) { in projectOMOs()
3095 if(nocc<Nind) { in projectOMOs()
[all …]
H A Dlinalg.cpp223 size_t Nind=0; in S_half_invhalf() local
226 Nind++; in S_half_invhalf()
228 size_t Ndep=Nbf-Nind; in S_half_invhalf()
233 for(size_t i=0;i<Nind;i++) { in S_half_invhalf()
H A Dscf-base.cpp1332 size_t Nind=AO_to_NO.n_cols; in ROHF_update() local
1338 size_t Nv=Nind-Na-Nc; in ROHF_update()
1353 for(size_t v=Nind-Nv;v<Nind;v++) { // Loop over virtuals in ROHF_update()
2920 size_t Nind=0; in project_orbitals() local
2923 Nind++; in project_orbitals()
2925 …ted basis has %i linearly independent and %i dependent functions.\n",(int) Nind,(int) (Ntot-Nind)); in project_orbitals()
2929 Svec=Svec.cols(Svec.n_cols-Nind,Svec.n_cols-1); in project_orbitals()
2932 arma::mat Sinvh(Ntot,Nind); in project_orbitals()
2933 for(size_t i=0;i<Nind;i++) in project_orbitals()
2937 arma::mat C(Ntot,Nind); in project_orbitals()
[all …]
H A Ddensity_fitting.cpp134 size_t Nind=0; in fill() local
137 Nind++; in fill()
140 abval=abval.subvec(abval.n_elem-Nind,abval.n_elem-1); in fill()
141 abvec=abvec.cols(abvec.n_cols-Nind,abvec.n_cols-1); in fill()
/dports/science/erkale/erkale-8297aefe5aac9dbbb291e04c07661f3cff94a99a/src/
H A Derifit.cpp544 size_t Nind=0; in compute_ERIfit() local
547 Nind++; in compute_ERIfit()
549 Sval=Sval.subvec(Sval.n_elem-Nind,Sval.n_elem-1); in compute_ERIfit()
550 Svec=Svec.cols(Svec.n_cols-Nind,Svec.n_cols-1); in compute_ERIfit()
637 size_t Nind=0; in compute_diag_ERIfit() local
640 Nind++; in compute_diag_ERIfit()
642 Sval=Sval.subvec(Sval.n_elem-Nind,Sval.n_elem-1); in compute_diag_ERIfit()
643 Svec=Svec.cols(Svec.n_cols-Nind,Svec.n_cols-1); in compute_diag_ERIfit()
H A Dbasis.cpp2906 size_t Nind=0; in projectMOs() local
2909 Nind++; in projectMOs()
2912 if(Nind<nocc) { in projectMOs()
2935 E.zeros(Nind); in projectMOs()
2965 if(nocc<Nind) { in projectMOs()
2983 MOs.cols(nocc,Nind-1)=Cnew.cols(nocc,Nind-1); in projectMOs()
3040 size_t Nind=0; in projectOMOs() local
3043 Nind++; in projectOMOs()
3046 if(Nind<nocc) { in projectOMOs()
3095 if(nocc<Nind) { in projectOMOs()
[all …]
H A Dlinalg.cpp227 size_t Nind=0; in S_half_invhalf() local
230 Nind++; in S_half_invhalf()
232 size_t Ndep=Nbf-Nind; in S_half_invhalf()
237 for(size_t i=0;i<Nind;i++) { in S_half_invhalf()
H A Dscf-base.cpp1342 size_t Nind=AO_to_NO.n_cols; in ROHF_update() local
1348 size_t Nv=Nind-Na-Nc; in ROHF_update()
1363 for(size_t v=Nind-Nv;v<Nind;v++) { // Loop over virtuals in ROHF_update()
2938 size_t Nind=0; in project_orbitals() local
2941 Nind++; in project_orbitals()
2943 …ted basis has %i linearly independent and %i dependent functions.\n",(int) Nind,(int) (Ntot-Nind)); in project_orbitals()
2947 Svec=Svec.cols(Svec.n_cols-Nind,Svec.n_cols-1); in project_orbitals()
2950 arma::mat Sinvh(Ntot,Nind); in project_orbitals()
2951 for(size_t i=0;i<Nind;i++) in project_orbitals()
2955 arma::mat C(Ntot,Nind); in project_orbitals()
[all …]
H A Ddensity_fitting.cpp134 size_t Nind=0; in fill() local
137 Nind++; in fill()
140 abval=abval.subvec(abval.n_elem-Nind,abval.n_elem-1); in fill()
141 abvec=abvec.cols(abvec.n_cols-Nind,abvec.n_cols-1); in fill()
/dports/cad/calculix-ccx/CalculiX/ccx_2.18/test/
H A Dcouseg3.inp92 *NSET,NSET=Nind
138 Nind
H A Dcouseg2.inp92 *NSET,NSET=Nind
138 Nind
/dports/science/helfem/HelFEM-21461e9/src/general/
H A Dscf_helpers.cpp491 size_t Nind=AO_to_NO.n_cols; in ROHF_update() local
497 size_t Nv=Nind-Na-Nc; in ROHF_update()
512 for(size_t v=Nind-Nv;v<Nind;v++) { // Loop over virtuals in ROHF_update()
/dports/science/py-scipy/scipy-1.7.1/scipy/sparse/csgraph/
H A D_shortest_path.pyx627 unsigned int Nind = source_indices.shape[0]
636 for i in range(Nind):
732 unsigned int Nind = dist_matrix.shape[0]
745 for i in range(Nind):
780 unsigned int Nind = source_indices.shape[0]
831 unsigned int Nind = dist_matrix.shape[0]
844 for i in range(Nind):
1076 unsigned int Nind = dist_matrix.shape[0]
1082 for i in range(Nind):
1117 unsigned int Nind = dist_matrix.shape[0]
[all …]
/dports/science/erkale/erkale-8297aefe5aac9dbbb291e04c07661f3cff94a99a/src/external/
H A Dfchkpt.cpp162 size_t Nind=Nbf*(Nbf+1)/2; in write_density() local
165 fprintf(out,"%-42s R %s %11i\n",entry.c_str(),"N=",(int) (Nind)); in write_density()
198 if(ntot!=Nind) in write_density()
/dports/science/erkale-pseudopotentials/erkale-870e772f09631b3dbdd99a18e4f3d4786d684a01/src/external/
H A Dfchkpt.cpp162 size_t Nind=Nbf*(Nbf+1)/2; in write_density() local
165 fprintf(out,"%-42s R %s %11i\n",entry.c_str(),"N=",(int) (Nind)); in write_density()
198 if(ntot!=Nind) in write_density()
/dports/lang/erlang-runtime23/otp-OTP-23.3.4.10/lib/stdlib/src/
H A Dio_lib_pretty.erl250 Nind = Nlen + 1,
251 {Col, Ind, S, W} = rec_indent(Nind, TInd, Col0, Ind0, W0),
1042 Nind = Nlen + 1,
1043 {Col, W} = cind_rec(Nind, Col0, Ll, M, Ind, W0),
/dports/lang/erlang-runtime21/otp-OTP-21.3.8.24/lib/stdlib/src/
H A Dio_lib_pretty.erl248 Nind = Nlen + 1,
249 {Col, Ind, S, W} = rec_indent(Nind, TInd, Col0, Ind0, W0),
1036 Nind = Nlen + 1,
1037 {Col, W} = cind_rec(Nind, Col0, Ll, M, Ind, W0),
/dports/lang/erlang-runtime22/otp-OTP-22.3.4.24/lib/stdlib/src/
H A Dio_lib_pretty.erl250 Nind = Nlen + 1,
251 {Col, Ind, S, W} = rec_indent(Nind, TInd, Col0, Ind0, W0),
1045 Nind = Nlen + 1,
1046 {Col, W} = cind_rec(Nind, Col0, Ll, M, Ind, W0),

12