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Searched refs:idomain (Results 1 – 25 of 26) sorted by relevance

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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Ddomain_submatrix_methods.F163 CALL copy_submatrix(original(idomain), copy(idomain), copy_data)
604 … CALL multiply_submatrices_once(transA, transB, alpha, A(idomain), B(idomain), beta, C(idomain))
812 CPASSERT(A(idomain)%nrows .EQ. B(idomain)%nrows)
813 CPASSERT(A(idomain)%ncols .EQ. B(idomain)%ncols)
907 IF (idomain .GT. 1) index_sr = domain_map%index1(idomain - 1)
1040 IF (idomain .GT. 1) index_sr = domain_map%index1(idomain - 1)
1178 submatrix(idomain)%domain = idomain
1185 IF (idomain .GT. 1) index_sr = domain_map%index1(idomain - 1)
1193 submatrix(idomain)%nbrows = submatrix(idomain)%nbrows + 1
1201 IF (idomain .GT. 1) index_sr = domain_map%index1(idomain - 1)
[all …]
H A Dalmo_scf_diis_types.F136 DO idomain = 1, ndomains
137 IF (diis_env%m_b(idomain)%domain .GT. 0) THEN
139 diis_env%m_b(idomain)%mdata(:, :) = 0.0_dp
198 DO idomain = 1, ndomains
199 IF (diis_env%m_b(idomain)%domain .GT. 0) THEN
201 diis_env%m_b(idomain)%mdata(:, :) = 0.0_dp
291 DO idomain = 1, ndomains
295 diis_env%m_b(idomain)%mdata(:, :)
304 DO idomain = 1, ndomains
305 IF (diis_env%m_b(idomain)%domain .GT. 0) THEN
[all …]
H A Dalmo_scf_methods.F824 DO idomain = 1, ndomains
1367 DO idomain = 1, ndomains
2368 DO idomain = 1, ndomains
2435 CALL copy_submatrices(subm_main(idomain), preconditioner(idomain), .FALSE.)
2508 DO idomain = 1, ndomains
2521 CALL copy_submatrices(subm_s(idomain), subm_s_sqrt(idomain), .FALSE.)
2524 CALL copy_submatrices(subm_s(idomain), subm_s_sqrt_inv(idomain), .FALSE.)
2581 DO idomain = 1, ndomains
2593 CALL copy_submatrices(subm_s(idomain), subm_s_inv(idomain), .FALSE.)
3203 DO idomain = 1, ndomains
[all …]
H A Dalmo_scf.F296 DO idomain = 1, ndomains
311 … almo_scf_env%nocc_of_domain(idomain, :) = CEILING(almo_scf_env%real_ne_of_domain(idomain, :)) &
340 DO idomain = 1, ndomains
349 DO idomain = 1, ndomains
367 DO idomain = 1, ndomains
1091 IF (idomain .EQ. 1) THEN
1099 nneighbors(idomain) = 0
1103 … nneighbors(idomain) = almo_scf_env%domain_map(1)%index1(idomain) - index1_prev - 1 ! minus self
1105 nneighbors(idomain) = -1
1141 idomain, almo_scf_env%nbasis_of_domain(idomain), &
[all …]
H A Dalmo_scf_qs.F857 iatom2, iblock_col, iblock_row, idomain, idomain2, ientry, igrid, ineig, ineighbor, & local
1489 DO idomain = 1, almo_scf_env%ndomains
1490 DO ineig = 1, domain_grid(idomain, 0) - 1
1491 almo_scf_env%domain_map(ispin)%pairs(ientry, 1) = domain_grid(idomain, ineig)
1492 almo_scf_env%domain_map(ispin)%pairs(ientry, 2) = idomain
1495 almo_scf_env%domain_map(ispin)%index1(idomain) = ientry
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Ddomain_submatrix_methods.F163 CALL copy_submatrix(original(idomain), copy(idomain), copy_data)
604 … CALL multiply_submatrices_once(transA, transB, alpha, A(idomain), B(idomain), beta, C(idomain))
812 CPASSERT(A(idomain)%nrows .EQ. B(idomain)%nrows)
813 CPASSERT(A(idomain)%ncols .EQ. B(idomain)%ncols)
907 IF (idomain .GT. 1) index_sr = domain_map%index1(idomain - 1)
1040 IF (idomain .GT. 1) index_sr = domain_map%index1(idomain - 1)
1178 submatrix(idomain)%domain = idomain
1185 IF (idomain .GT. 1) index_sr = domain_map%index1(idomain - 1)
1193 submatrix(idomain)%nbrows = submatrix(idomain)%nbrows + 1
1201 IF (idomain .GT. 1) index_sr = domain_map%index1(idomain - 1)
[all …]
H A Dalmo_scf_diis_types.F136 DO idomain = 1, ndomains
137 IF (diis_env%m_b(idomain)%domain .GT. 0) THEN
139 diis_env%m_b(idomain)%mdata(:, :) = 0.0_dp
198 DO idomain = 1, ndomains
199 IF (diis_env%m_b(idomain)%domain .GT. 0) THEN
201 diis_env%m_b(idomain)%mdata(:, :) = 0.0_dp
291 DO idomain = 1, ndomains
295 diis_env%m_b(idomain)%mdata(:, :)
304 DO idomain = 1, ndomains
305 IF (diis_env%m_b(idomain)%domain .GT. 0) THEN
[all …]
H A Dalmo_scf_methods.F781 DO idomain = 1, ndomains
1324 DO idomain = 1, ndomains
2314 DO idomain = 1, ndomains
2381 CALL copy_submatrices(subm_main(idomain), preconditioner(idomain), .FALSE.)
2452 DO idomain = 1, ndomains
2465 CALL copy_submatrices(subm_s(idomain), subm_s_sqrt(idomain), .FALSE.)
2468 CALL copy_submatrices(subm_s(idomain), subm_s_sqrt_inv(idomain), .FALSE.)
2525 DO idomain = 1, ndomains
2537 CALL copy_submatrices(subm_s(idomain), subm_s_inv(idomain), .FALSE.)
3147 DO idomain = 1, ndomains
[all …]
H A Dalmo_scf.F285 DO idomain = 1, ndomains
300 … almo_scf_env%nocc_of_domain(idomain, :) = CEILING(almo_scf_env%real_ne_of_domain(idomain, :)) &
329 DO idomain = 1, ndomains
338 DO idomain = 1, ndomains
356 DO idomain = 1, ndomains
1078 IF (idomain .EQ. 1) THEN
1086 nneighbors(idomain) = 0
1090 … nneighbors(idomain) = almo_scf_env%domain_map(1)%index1(idomain) - index1_prev - 1 ! minus self
1092 nneighbors(idomain) = -1
1128 idomain, almo_scf_env%nbasis_of_domain(idomain), &
[all …]
H A Dalmo_scf_qs.F857 iatom2, iblock_col, iblock_row, idomain, idomain2, ientry, igrid, ineig, ineighbor, & local
1489 DO idomain = 1, almo_scf_env%ndomains
1490 DO ineig = 1, domain_grid(idomain, 0) - 1
1491 almo_scf_env%domain_map(ispin)%pairs(ientry, 1) = domain_grid(idomain, ineig)
1492 almo_scf_env%domain_map(ispin)%pairs(ientry, 2) = idomain
1495 almo_scf_env%domain_map(ispin)%index1(idomain) = ientry
/dports/cad/calculix-ccx/CalculiX/ccx_2.18/src/
H A Dmagneticpermeabilitys.f32 & inp(3,*),idomain,ier local
96 read(textpart(2)(1:10),'(i10)',iostat=istat) idomain
102 elcon(2,ntmat,nmat)=idomain+0.5d0
H A Dmastructem.c43 *irow=NULL,mt=mi[1]+1,imat,idomain,jmin,jmax,*next=NULL,jstart; in mastructem() local
79 idomain=(ITG)elcon[(*ncmat_+1)**ntmat_*(imat-1)+2]; in mastructem()
80 if(idomain==1){ in mastructem()
82 }else if(idomain==2){ in mastructem()
84 }else if(idomain==3){ in mastructem()
112 idomain=(ITG)elcon[(*ncmat_+1)**ntmat_*(imat-1)+2]; in mastructem()
113 if(idomain!=2) continue; in mastructem()
382 idomain=(ITG)elcon[(*ncmat_+1)**ntmat_*(imat-1)+2]; in mastructem()
383 if(idomain!=2) continue; in mastructem()
/dports/net/p5-URI/URI-5.10/lib/URI/
H A D_idna.pm24 my $idomain = shift;
25 my @labels = split(/\./, $idomain, -1);
/dports/science/qmcpack/qmcpack-3.11.0/src/QMCHamiltonians/
H A DSpaceGrid.cpp530 int idomain = dm[0] * i + dm[1] * j + dm[2] * k; in initialize_rectilinear() local
574 domain_volumes(idomain, 0) = vol; in initialize_rectilinear()
577 domain_uwidths(idomain, d) = du[d]; in initialize_rectilinear()
578 domain_centers(idomain, d) = rc[d]; in initialize_rectilinear()
1095 int idomain; in check_grid() local
1124 idomain = dm[0] * iu[0] + dm[1] * iu[1] + dm[2] * iu[2]; in check_grid()
1125 if (idomain != i) in check_grid()
1127 app_log() << " cell mismatch " << i << " " << idomain << std::endl; in check_grid()
/dports/net/binkd/binkd-1.0.4/
H A Dftnaddr.c279 if (d && d->idomain) in ftnaddress_to_domain()
280 strnzcat (s, d->idomain, BINKD_FQDNLEN); in ftnaddress_to_domain()
H A Dbtypes.h85 char *idomain; /* internet root-domain */ member
H A Dperlhooks.c1374 if (cur->idomain) { in perl_setup()
1375 VK_ADD_HASH_str(hv2, sv, "root_domain", cur->idomain); in perl_setup()
1381 if (cur->idomain) { in perl_setup()
1382 VK_ADD_HASH_str(hv2, sv, "root_domain", cur->idomain); in perl_setup()
H A Dreadcfg.c511 xfree(pp->idomain); in destroy_domains()
1485 new_domain.idomain = xstrdup(words[3]); in read_domain_info()
/dports/mail/libdkim/libdkim/src/
H A Ddkimverify.cpp1031 char *idomain = at+1; in ParseDKIMSignature() local
1034 int idomainlen = strlen(idomain); in ParseDKIMSignature()
1040 if (_stricmp(idomain+idomainlen-ddomainlen, values[3]) != 0) in ParseDKIMSignature()
1042 if (idomainlen > ddomainlen && idomain[idomainlen-ddomainlen-1] != '.') in ParseDKIMSignature()
1046 sig.IdentityDomain = idomain; in ParseDKIMSignature()
/dports/www/chromium-legacy/chromium-88.0.4324.182/components/test/data/autofill/heuristics/output/
H A D057_register_live.com.out2 UNKNOWN_TYPE | idomain | Domains | hotmail.com | imembernamelive_1-default
H A D070_register_signup.live.com.out2 UNKNOWN_TYPE | idomain | Domains | hotmail.com | imembernamelive_1-default
/dports/science/conduit/conduit-0.8.0/src/tests/blueprint/
H A Dt_blueprint_mesh_transform.cpp667 Node &idomain = imesh[domain_name]; in TEST() local
670 Node &iadjset = idomain["adjsets"].child(0); in TEST()
/dports/deskutils/calibre/calibre-src-5.34.0/src/calibre/ebooks/metadata/sources/
H A Damazon.py1192 idomain, asin = self.get_domain_and_asin(identifiers)
1193 if idomain is not None:
1194 domain = idomain
/dports/cad/netgen/netgen-6.2.2105/libsrc/meshing/
H A Dpython_mesh.cpp1103 auto idomain = *get_if<int>(&domain); in ExportNetgenMeshing() local
1104 blp.domains.SetBit(idomain); in ExportNetgenMeshing()
/dports/science/qmcpack/qmcpack-3.11.0/nexus/lib/
H A Dqmcpack_quantity_analyzers.py2940 idomain = dm[0]*i + dm[1]*j + dm[2]*k
2976 domain_volumes[idomain] = vol
2978 domain_uwidths[idomain,d] = du[d]
2979 domain_centers[idomain,d] = rc[d]

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