| /dports/science/bagel/bagel-1.2.2/src/multi/casscf/ |
| H A D | casgrad.cc | 70 auto rdms = ref_->rdm1_mat(istate); in compute_dipole() local
71 shared_ptr<Matrix> dtot = rdms->resize(nmobasis, nmobasis); in compute_dipole()
84 auto rdms = ref_->rdm1_mat_tr(rdm1_tr); in compute_dipole() local
85 rdms->symmetrize(); in compute_dipole()
86 shared_ptr<Matrix> dtot = rdms->resize(nmobasis, nmobasis); in compute_dipole()
206 shared_ptr<const Matrix> rdms; in compute() local
211 rdms = make_shared<const Matrix>(*tmp); in compute()
214 rdms = ref_->rdm1_mat(istate); in compute()
220 g0->add_block(2.0, 0, 0, nmobasis, nocc, *hmo ^ *rdms); in compute()
249 Dipole dipole(geom_, make_shared<Matrix>(ocoeff * *rdms ^ ocoeff), tdmlabel); in compute()
[all …]
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| /dports/science/py-OpenFermion/OpenFermion-1.3.0/src/openfermion/linalg/ |
| H A D | erpa_test.py | 42 rdms = InteractionRDM(opdm, tpdm)
64 true = rdms.expectation(get_interaction_operator(erpa_op))
78 rdms = InteractionRDM(opdm, tpdm)
101 true = rdms.expectation(get_interaction_operator(erpa_op))
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| /dports/science/py-OpenFermion/OpenFermion-1.3.0/src/openfermion/hamiltonians/ |
| H A D | hartree_fock.py | 138 rdms = InteractionRDM(opdm, 2 * tpdm)
139 return rdms
151 rdms = self.rdms_from_rhf_opdm(opdm_aa)
152 return rdms.expectation(self.hamiltonian).real
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| /dports/astro/stellarium/stellarium-0.21.3/src/tests/ |
| H A D | testConversions.cpp | 283 QString rdms = StelUtils::radToDmsStrAdapt(rad, flag); in testRadToDMSStrAdapt() local
284 QVERIFY2(rdms==edms, qPrintable(QString("%1 radians = %2 (expected %3) [flag: %4]") in testRadToDMSStrAdapt()
286 .arg(rdms) in testRadToDMSStrAdapt()
382 QString rdms = StelUtils::radToDmsStr(rad, decimalF, useDF); in testRadToDMSStr() local
383 QVERIFY2(rdms==edms, qPrintable(QString("%1 radians = %2 (expected %3) [flags: %4, %5]") in testRadToDMSStr()
385 .arg(rdms) in testRadToDMSStr()
482 QString rdms = StelUtils::radToDmsPStr(rad, precission, flag); in testRadToDMSPStr() local
483 …QVERIFY2(rdms==edms, qPrintable(QString("%1 radians = %2 (expected %3) [precission: %4; flag: %5]") in testRadToDMSPStr()
485 .arg(rdms) in testRadToDMSPStr()
|
| /dports/shells/ohmyzsh/ohmyzsh-6babcbd8841335a3c25ec960ff57ab9a139c9073/plugins/rails/ |
| H A D | rails.plugin.zsh | 61 alias rdms='rake db:migrate:status' alias
|
| H A D | README.md | 36 | `rdms` | `rake db:migrate:status` | Show current db migration status …
|
| /dports/biology/sra-tools/sra-tools-2.11.0/tools/bam-loader/ |
| H A D | bam.c | 1157 unsigned rdms; in ReadHeaders() local
1188 rdms = nrefs * 16; in ReadHeaders()
1189 if (rdms < 4096) in ReadHeaders()
1190 rdms = 4096; in ReadHeaders()
1191 rdat = malloc(rdms); in ReadHeaders()
1202 if (rdsz + i32 + 8 > rdms) { in ReadHeaders()
1205 do { rdms <<= 1; } while (rdsz + i32 + 8 > rdms); in ReadHeaders()
1206 tmp = realloc(rdat, rdms); in ReadHeaders()
|
| /dports/lang/slib/slib-3b6/ |
| H A D | ChangeLog | 2113 * rdms.scm (domains:init-data): Simplified.
2114 (slib:error): Replaces alias rdms:error.
2129 * rdms.scm (isam-prev isam-next): Added.
2152 * rdms.scm (catalog:init-cols): TABLE-NAME now symbol.
2171 * rdms.scm (combine-primary-keys): Removed primary-limit
2577 (rdms:warn): Commented out unused definitions.
3638 * rdms.scm (close-database): Fixed return value.
4472 * rdms.scm (sync-database): Added.
4887 * rdms.scm (domains:init-data): added number domain.
5265 * rdms.scm (write-database): was not returning status.
[all …]
|
| H A D | slib.nsi | 248 File "rdms.scm"
502 Delete "$INSTDIR\rdms.scm"
|
| H A D | Makefile | 74 rfiles = rdms.scm alistab.scm paramlst.scm \
|
| H A D | README | 107 `rdms.scm' has code to construct a relational database from a base
|
| /dports/biology/sra-tools/sra-tools-2.11.0/ncbi-vdb/libs/align/ |
| H A D | bam.c | 1494 unsigned rdms; in ReadHeaders() local
1525 rdms = nrefs * 16; in ReadHeaders()
1526 if (rdms < 4096) in ReadHeaders()
1527 rdms = 4096; in ReadHeaders()
1528 rdat = malloc(rdms); in ReadHeaders()
1539 if (rdsz + i32 + 8 > rdms) { in ReadHeaders()
1542 do { rdms <<= 1; } while (rdsz + i32 + 8 > rdms); in ReadHeaders()
1543 tmp = realloc(rdat, rdms); in ReadHeaders()
|
| /dports/biology/ncbi-vdb/ncbi-vdb-2.11.0/libs/align/ |
| H A D | bam.c | 1494 unsigned rdms; in ReadHeaders() local
1525 rdms = nrefs * 16; in ReadHeaders()
1526 if (rdms < 4096) in ReadHeaders()
1527 rdms = 4096; in ReadHeaders()
1528 rdat = malloc(rdms); in ReadHeaders()
1539 if (rdsz + i32 + 8 > rdms) { in ReadHeaders()
1542 do { rdms <<= 1; } while (rdsz + i32 + 8 > rdms); in ReadHeaders()
1543 tmp = realloc(rdat, rdms); in ReadHeaders()
|
| /dports/japanese/ddskk/ddskk-16.2/READMEs/ |
| H A D | AUTHORS.ja | 280 skk-vars.el, skk-leim.el, skk-kakasi.el, skk-rdms.el, skk-jisx0201.el
|
| /dports/chinese/rime-scj/rime-scj-cab5a0858765eff0553dd685a2d61d5536e9149c/ |
| H A D | scj6.dict.yaml | 43541 呠 rdms
|
| /dports/chinese/brise/brise-brise-0.35/extra/ |
| H A D | scj6.dict.yaml | 43558 呠 rdms
|
| /dports/japanese/scim-tables/scim-tables-0.5.10/tables/zh/ |
| H A D | SmartCangJie6.txt.in | 46077 rdms 呠 500
|
| /dports/chinese/scim-tables/scim-tables-0.5.10/tables/zh/ |
| H A D | SmartCangJie6.txt.in | 46077 rdms 呠 500
|
| /dports/textproc/scim-table-imengine/scim-tables-0.5.10/tables/zh/ |
| H A D | SmartCangJie6.txt.in | 46077 rdms 呠 500
|
| /dports/korean/scim-tables/scim-tables-0.5.10/tables/zh/ |
| H A D | SmartCangJie6.txt.in | 46077 rdms 呠 500
|
| /dports/textproc/py-orange3-text/orange3-text-1.3.1/orangecontrib/text/datasets/ |
| H A D | 20newsgroups-train.tab | 1106 …ion of a new newsgroup for the general discussion of the microsoft access rdms name comp databases…
1136 …ion of a new newsgroup for the general discussion of the microsoft access rdms name comp databases…
|