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| ergo/ergo-3.8.2/aclocal.m4 | 63 | 65 | license | fsf-unlimited |
| ergo/ergo-3.8.2/aclocal.m4 | 115 | 117 | license | fsf-unlimited |
| ergo/ergo-3.8.2/aclocal.m4 | 146 | 148 | license | fsf-unlimited |
| ergo/ergo-3.8.2/aclocal.m4 | 337 | 339 | license | fsf-unlimited |
| ergo/ergo-3.8.2/aclocal.m4 | 405 | 407 | license | fsf-unlimited |
| ergo/ergo-3.8.2/aclocal.m4 | 620 | 622 | license | fsf-unlimited |
| ergo/ergo-3.8.2/aclocal.m4 | 641 | 643 | license | fsf-unlimited |
| ergo/ergo-3.8.2/aclocal.m4 | 662 | 664 | license | fsf-unlimited |
| ergo/ergo-3.8.2/aclocal.m4 | 705 | 707 | license | fsf-unlimited |
| ergo/ergo-3.8.2/aclocal.m4 | 739 | 741 | license | fsf-unlimited |
| ergo/ergo-3.8.2/aclocal.m4 | 768 | 770 | license | fsf-unlimited |
| ergo/ergo-3.8.2/aclocal.m4 | 815 | 817 | license | fsf-unlimited |
| ergo/ergo-3.8.2/aclocal.m4 | 834 | 836 | license | fsf-unlimited |
| ergo/ergo-3.8.2/aclocal.m4 | 915 | 917 | license | fsf-unlimited |
| ergo/ergo-3.8.2/aclocal.m4 | 975 | 977 | license | fsf-unlimited |
| ergo/ergo-3.8.2/aclocal.m4 | 1003 | 1005 | license | fsf-unlimited |
| ergo/ergo-3.8.2/aclocal.m4 | 1022 | 1024 | license | fsf-unlimited |
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| ergo/ergo-3.8.2/configure | 1535 | 1536 | license | fsf-free |
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| ergo/ergo-3.8.2/source/dft/lebedev_laikov.cc | 6 | 17 | license | gpl-3.0-plus |
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| ergo/ergo-3.8.2/source/utilities_basic/file_tools/test/test.cc | 6 | 17 | license | gpl-3.0-plus |
| ergo/ergo-3.8.2/test/Makefile.in | 6 | 13 | license | fsf-unlimited-no-warranty |
| path | type | name | extension | date | size | sha1 | md5 | files_count | mime_type | file_type | programming_language | is_binary | is_text | is_archive | is_media | is_source | is_script |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| ergo | directory | ||||||||||||||||
| ergo/ergo-3.8.2-SPECPARTS | directory | ||||||||||||||||
| ergo/ergo-3.8.2.tar.gz | file | ||||||||||||||||
| ergo/ergo.spec | file | ||||||||||||||||
| ergo/sources | file | ||||||||||||||||
| ergo/ergo-3.8.2 | directory | ||||||||||||||||
| ergo/ergo-3.8.2/aclocal.m4 | file | ||||||||||||||||
| ergo/ergo-3.8.2/bootstrap.sh | file | ||||||||||||||||
| ergo/ergo-3.8.2/compile | file | ||||||||||||||||
| ergo/ergo-3.8.2/config.guess | file | ||||||||||||||||
| ergo/ergo-3.8.2/config.sub | file | ||||||||||||||||
| ergo/ergo-3.8.2/config_examples.txt | file | ||||||||||||||||
| ergo/ergo-3.8.2/configure | file | ||||||||||||||||
| ergo/ergo-3.8.2/configure.ac | file | ||||||||||||||||
| ergo/ergo-3.8.2/COPYING | file | ||||||||||||||||
| ergo/ergo-3.8.2/depcomp | file | ||||||||||||||||
| ergo/ergo-3.8.2/Doxyfile | file | ||||||||||||||||
| ergo/ergo-3.8.2/ergo_license_long.txt | file | ||||||||||||||||
| ergo/ergo-3.8.2/ergo_release_notes_3_8.txt | file | ||||||||||||||||
| ergo/ergo-3.8.2/ergo_release_notes_3_8_1.txt | file | ||||||||||||||||
| ergo/ergo-3.8.2/ergo_release_notes_3_8_2.txt | file | ||||||||||||||||
| ergo/ergo-3.8.2/install-sh | file | ||||||||||||||||
| ergo/ergo-3.8.2/Makefile.am | file | ||||||||||||||||
| ergo/ergo-3.8.2/Makefile.in | file | ||||||||||||||||
| ergo/ergo-3.8.2/missing | file | ||||||||||||||||
| ergo/ergo-3.8.2/README | file | ||||||||||||||||
| ergo/ergo-3.8.2/test-driver | file | ||||||||||||||||
| ergo/ergo-3.8.2/ylwrap | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis | directory | ||||||||||||||||
| ergo/ergo-3.8.2/basis/3-21++G | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/3-21++Gs | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/3-21G | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/3-21Gs | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/4-31G | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/6-31++G | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/6-31++Gs | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/6-31++Gss | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/6-31+G | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/6-311++G_2d,2p_ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/6-311++Gss | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/6-311+Gs | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/6-311G | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/6-311Gs | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/6-311Gss | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/6-31G | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/6-31Gfixed | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/6-31Gs | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/6-31Gss | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Ahlrichs-Coulomb-Fit | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Ahlrichs-pVDZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Ahlrichs-TZV | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Ahlrichs-VDZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Ahlrichs-VTZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/AhlrichsDenFit | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/AhlrichsVDZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/AhlrichsVTZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Almlof-Taylor-ANO | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/ano-1 | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/ano-2 | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/ano-3 | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/ano-4 | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/ano-5 | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/aug-cc-pCV5Z | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/aug-cc-pCVDZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/aug-cc-pCVQZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/aug-cc-pCVTZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/aug-cc-pCVTZ-CTOCD-uc | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/aug-cc-pV5Z | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/aug-cc-pV6Z | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/aug-cc-pV_5+d_Z | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/aug-cc-pV_6+d_Z | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/aug-cc-pV_D+d_Z | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/aug-cc-pV_Q+d_Z | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/aug-cc-pV_T+d_Z | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/aug-cc-pVDZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/aug-cc-pVQZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/aug-cc-pVTZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/aug-cc-pVTZ-J | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/aug-pV7Z | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pCV5Z | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pCVDZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pCVQZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pCVTZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pV5Z | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pV5Z-DK | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pV5Zdenfit | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pV6Z | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pV_5+d_Z | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pV_6+d_Z | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pV_D+d_Z | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pV_Q+d_Z | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pV_T+d_Z | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pVDZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pVDZ-DK | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pVQZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pVQZ-DK | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pVQZdenfit | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pVTZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pVTZ-DK | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pVTZdenfit | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pwCV5Z | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pwCVDZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pwCVQZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/cc-pwCVTZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/DunningDZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/DunningTZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/ECP | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/ecp-sdd-DZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/ecp-sdd-pseudo | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/ECP_pseudo | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/GAMESS-PVTZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/GAMESS-VTZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Huckel | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Huz-II | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Huz-III | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Huz-IIIsu3 | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Huz-IIsu2 | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Huz-IV | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Huz-IVsu4 | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/hybrid-guess-basis | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/japrtano | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Makefile.am | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Makefile.in | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/McLean-Chandler-VTZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/MIDI | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/NASA-Ames-ANO | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/NQvD | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/pV6Z | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/pV7Z | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/raf-r | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/RoosAugDZANO | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/sad-J | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/sadlej | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Sadlej-pVTZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Sadlej-pVTZ-J | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/STO-1G | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/STO-2G | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/STO-3G | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/STO-6G | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Turbomole-DZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Turbomole-DZP | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Turbomole-QZV | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Turbomole-QZVP | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Turbomole-QZVPP | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Turbomole-SV | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Turbomole-SVP | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Turbomole-TZ | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Turbomole-TZP | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Turbomole-TZV | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Turbomole-TZVP | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Turbomole-TZVPP | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Turbomole-TZVPPP | file | ||||||||||||||||
| ergo/ergo-3.8.2/basis/Wachtersa+f | file | ||||||||||||||||
| ergo/ergo-3.8.2/documentation | directory | ||||||||||||||||
| ergo/ergo-3.8.2/documentation/source | directory | ||||||||||||||||
| ergo/ergo-3.8.2/documentation/source/mainpage.h | file | ||||||||||||||||
| ergo/ergo-3.8.2/documentation/source/Makefile.am | file | ||||||||||||||||
| ergo/ergo-3.8.2/documentation/source/Makefile.in | file | ||||||||||||||||
| ergo/ergo-3.8.2/mol | directory | ||||||||||||||||
| ergo/ergo-3.8.2/mol/ch4_040.mol | file | ||||||||||||||||
| ergo/ergo-3.8.2/mol/cnof.mol | file | ||||||||||||||||
| ergo/ergo-3.8.2/mol/four_h2o.mol | file | ||||||||||||||||
| ergo/ergo-3.8.2/mol/GluAla2.xyz | file | ||||||||||||||||
| ergo/ergo-3.8.2/mol/h2.mol | file | ||||||||||||||||
| ergo/ergo-3.8.2/mol/h2o.mol | file | ||||||||||||||||
| ergo/ergo-3.8.2/mol/h2o_1000.xyz | file | ||||||||||||||||
| ergo/ergo-3.8.2/mol/h2o_125_1.xyz | file | ||||||||||||||||
| ergo/ergo-3.8.2/mol/h2o_125_2.xyz | file | ||||||||||||||||
| ergo/ergo-3.8.2/mol/h2o_125_3.xyz | file | ||||||||||||||||
| ergo/ergo-3.8.2/mol/h2o_125_4.xyz | file | ||||||||||||||||
| ergo/ergo-3.8.2/mol/h2o_216.xyz | file | ||||||||||||||||
| ergo/ergo-3.8.2/mol/h2o_3.xyz | file | ||||||||||||||||
| ergo/ergo-3.8.2/mol/h2o_a.xyz | file | ||||||||||||||||
| ergo/ergo-3.8.2/mol/h2o_b.xyz | file | ||||||||||||||||
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| ergo/ergo-3.8.2/mol/nh3.mol | file | ||||||||||||||||
| ergo/ergo-3.8.2/params | directory | ||||||||||||||||
| ergo/ergo-3.8.2/params/h2o_hf321g.ego | file | ||||||||||||||||
| ergo/ergo-3.8.2/params/hf321g.ego | file | ||||||||||||||||
| ergo/ergo-3.8.2/params/hf321g_for_tests.ego | file | ||||||||||||||||
| ergo/ergo-3.8.2/params/lr.ego | file | ||||||||||||||||
| ergo/ergo-3.8.2/params/Makefile.am | file | ||||||||||||||||
| ergo/ergo-3.8.2/params/Makefile.in | file | ||||||||||||||||
| ergo/ergo-3.8.2/source | directory | ||||||||||||||||
| ergo/ergo-3.8.2/source/bin2m.cc | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/config.h.in | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/ergo_input_parser.c | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/ergo_input_parser.l | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/ergo_input_processor.c | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/ergo_input_processor.h | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/ergo_input_processor.y | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/ergo_scripted.cc | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/ergo_scripted.h | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/fermi_contact.cc | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/license.h | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/Makefile.am | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/Makefile.in | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/matrix_typedefs.h | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/matrix_typedefs_chtml.h | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/registration.cc | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/registration.h | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/slr.cc | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/slr.h | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/transform.h | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/basisset | directory | ||||||||||||||||
| ergo/ergo-3.8.2/source/basisset/basisinfo.cc | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/basisset/basisinfo.h | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/basisset/basisset.cc | file | ||||||||||||||||
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| ergo/ergo-3.8.2/source/ci | directory | ||||||||||||||||
| ergo/ergo-3.8.2/source/ci/ci.cc | file | ||||||||||||||||
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| ergo/ergo-3.8.2/source/ci/Makefile.in | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/densfromf | directory | ||||||||||||||||
| ergo/ergo-3.8.2/source/densfromf/densfromf_full.cc | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/densfromf/densfromf_full.h | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/densfromf/GetDensFromFock.cc | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/densfromf/GetDensFromFock.h | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/densfromf/Makefile.am | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/densfromf/Makefile.in | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/densfromf/recursive_expansion | directory | ||||||||||||||||
| ergo/ergo-3.8.2/source/densfromf/recursive_expansion/Makefile.am | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/densfromf/recursive_expansion/Makefile.in | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/densfromf/recursive_expansion/eigenvectors | directory | ||||||||||||||||
| ergo/ergo-3.8.2/source/densfromf/recursive_expansion/eigenvectors/Makefile.am | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/densfromf/recursive_expansion/eigenvectors/Makefile.in | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/densfromf/recursive_expansion/eigenvectors/src | directory | ||||||||||||||||
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| ergo/ergo-3.8.2/source/densfromf/recursive_expansion/eigenvectors/test | directory | ||||||||||||||||
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| ergo/ergo-3.8.2/source/matrix/gemm_sse/vector_intrin.h | file | ||||||||||||||||
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| ergo/ergo-3.8.2/source/matrix/template_lapack/COPYING | file | ||||||||||||||||
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| ergo/ergo-3.8.2/source/matrix/template_lapack/blas/test.sh | file | ||||||||||||||||
| ergo/ergo-3.8.2/source/matrix/template_lapack/lapack | directory | ||||||||||||||||
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