"Fossies" - the Fresh Open Source Software Archive

Contents of cp2k-6.1.tar.bz2 (12 Jun 15:52, 55139278 Bytes)

About: CP2K is a quantum chemistry and solid state physics software package that can perform atomistic simulations of solid state, liquid, molecular, periodic, material, crystal, and biological systems (written in Fortran 2003).



Fossies download: /linux/misccp2k-6.1.tar.bz2  (tar.gz|tar.xz|zip)
Original URL: http://sourceforge.net/projects/cp2k/files/cp2k-6.1.tar.bz2
Fossies services: Doxygen docs | Diffs report | CLOC analysis
VirusTotal check: Ok
Member paths+URLs:  Shortened | full
Member sort order:  docs related (infos|docs|other) | original | size (top100) | date | path | name | ext | top-path files

Basic infos (README, FAQ, INSTALL, ChangeLog, ...):
-rw-r--r--     2400 2018-01-01 03:06 COPYRIGHT
-rw-r--r--    17463 2018-02-12 14:13 INSTALL
-rw-r--r--      734 2018-04-25 20:07 README
-rw-r--r--       10 2018-06-11 12:28 REVISION
-rw-r--r--    16265 2016-04-12 12:32 tools/svn2cl/ChangeLog
-rw-r--r--     4006 2013-08-09 19:44 tools/svn2cl/NEWS
-rw-r--r--     6266 2016-02-09 02:09 tools/toolchain/README_FOR_DEVELOPERS
-rw-r--r--     3033 2016-03-05 19:14 tools/toolchain/README_FOR_USERS
-rw-r--r--     1066 2018-04-16 19:56 tools/dbcsr_test/README
-rw-r--r--     1273 2008-12-09 12:11 tools/Fun2D/README
-rw-r--r--      189 2018-03-20 11:32 tools/prettify/README
-rw-r--r--     2370 2015-02-26 23:33 tools/benchmark_plots/README
-rw-r--r--      400 2005-10-20 09:18 tools/manual/README
-rw-r--r--     4231 2013-08-09 19:44 tools/svn2cl/README
-rw-r--r--      476 2016-07-23 14:44 tools/minimax_tools/README
-rw-r--r--      599 2009-05-13 15:01 tools/scriptmini/README
-rw-r--r--     6043 2014-06-16 17:11 tools/doxify/README
-rw-r--r--     6246 2016-10-27 10:07 tools/autotune_grid/README
-rw-r--r--     8505 2015-11-06 14:57 tools/build_libsmm/README

Basic docs (manual pages, PDF-,HTML-,/doc/-files, ...):
-rw-r--r--      929 2018-05-29 20:48 tools/toolchain/Dockerfile
-rw-r--r--     7280 2018-06-11 13:48 tools/manual/index.html
lrwxrwxrwx        0 2018-06-12 15:22 tools/docker/test_coverage-pdbg -> regtest
lrwxrwxrwx        0 2018-06-12 15:22 tools/docker/test_coverage-sdbg -> regtest
-rw-r--r--     8805 2013-08-09 19:44 tools/svn2cl/svn2cl.1

First 50 (from 5917) other files:
-rw-r--r--     3643 2014-09-17 09:20 tests/Fist/regtest-14/11_exvdw_11_exei.inp
-rw-r--r--     3574 2014-09-17 09:20 tests/Fist/regtest-14/11_exvdw_12_exei.inp
-rw-r--r--     3574 2014-09-17 09:20 tests/Fist/regtest-14/12_exvdw_12_exei.inp
-rw-r--r--     3587 2014-09-17 09:20 tests/Fist/regtest-14/12_exvdw_12_exei_list_1_check.inp
-rw-r--r--     3669 2014-09-17 09:20 tests/Fist/regtest-14/12_exvdw_12_exei_list_1.inp
-rw-r--r--     3636 2014-09-17 09:20 tests/Fist/regtest-14/12_exvdw_12_exei_list_2_c.inp
-rw-r--r--     3669 2014-09-17 09:20 tests/Fist/regtest-14/12_exvdw_12_exei_list_2.inp
-rw-r--r--     3654 2014-09-17 09:20 tests/Fist/regtest-14/12_exvdw_12_exei_list_empty.inp
-rw-r--r--      892 2013-08-29 12:27 tests/Fist/regtest-1-3/1atom_multipole.inp
-rw-r--r--       50 2012-12-24 11:22 tests/QS/regtest-xc/1H2_PBE.inp
-rw-r--r--       53 2012-12-24 11:22 tests/QS/regtest-xc/1H2_PBEsol.inp
-rw-r--r--       83 2012-12-24 11:22 tests/QS/regtest-xc/1He_PBE0.inp
-rw-r--r--       82 2012-12-24 11:22 tests/QS/regtest-xc/1He_PBE.inp
-rw-r--r--       86 2012-12-24 11:22 tests/QS/regtest-xc/1He_PBEsol0.inp
-rw-r--r--       85 2012-12-24 11:22 tests/QS/regtest-xc/1He_PBEsol.inp
-rw-r--r--       83 2012-12-24 11:22 tests/QS/regtest-xc/1Ne_PBE0.inp
-rw-r--r--       82 2012-12-24 11:22 tests/QS/regtest-xc/1Ne_PBE.inp
-rw-r--r--       86 2012-12-24 11:22 tests/QS/regtest-xc/1Ne_PBEsol0.inp
-rw-r--r--       85 2012-12-24 11:22 tests/QS/regtest-xc/1Ne_PBEsol.inp
-rw-r--r--     1927 2010-12-28 14:33 tests/Fist/regtest-3/2d_pot.inp
-rw-r--r--     1844 2010-12-28 14:33 tests/NEB/regtest-1/2gly_B-NEB.inp
-rw-r--r--     1881 2010-12-28 14:33 tests/NEB/regtest-1/2gly_CI-NEB.inp
-rw-r--r--     1646 2015-07-14 10:45 tests/NEB/regtest-2/2gly_DIIS-DNEB.inp
-rw-r--r--     1665 2015-07-14 10:45 tests/NEB/regtest-2/2gly_DIIS-NEB.inp
-rw-r--r--     1679 2013-02-13 17:11 tests/NEB/regtest-2/2gly_DIIS-OEP-NEB.inp
-rw-r--r--     1635 2010-12-28 14:33 tests/NEB/regtest-2/2gly_DIIS-SD-2.inp
-rw-r--r--     1598 2010-12-28 14:33 tests/NEB/regtest-2/2gly_DIIS-SD-NEB.inp
-rw-r--r--     1668 2015-07-14 10:45 tests/NEB/regtest-2/2gly_DIIS-SM.inp
-rw-r--r--     1839 2010-12-28 14:33 tests/NEB/regtest-1/2gly_EB-NEB.inp
-rw-r--r--     2231 2009-11-10 01:00 tests/NEB/regtest-4/2gly_IT-NEB-CV.inp
-rw-r--r--     2251 2010-11-22 18:01 tests/NEB/regtest-4/2gly_IT-NEB-CV-res.inp
-rw-r--r--     1846 2010-12-28 14:33 tests/NEB/regtest-1/2gly_IT-NEB.inp
-rw-r--r--     1908 2009-11-10 01:00 tests/NEB/regtest-3/2gly_IT-NEB.inp
-rw-r--r--     1925 2010-11-22 18:01 tests/NEB/regtest-3/2gly_IT-NEB-res.inp
-rw-r--r--     2664 2010-12-28 14:33 tests/Fist/regtest-10/2gly_mtd_dprmsd.inp
-rw-r--r--     3241 2010-12-28 14:33 tests/Fist/regtest-10/2gly_mtd_rp_dp_rmsd.inp
-rw-r--r--     2664 2010-12-28 14:33 tests/Fist/regtest-10/2gly_mtd_rprmsd.inp
-rw-r--r--     1018 2010-01-25 18:24 tests/Fist/sample_pdb/2gly.pdb
-rw-r--r--     4827 2010-01-25 18:24 tests/Fist/sample_pot/2gly.pot
-rw-r--r--     3052 2010-01-25 18:24 tests/Fist/sample_psf/2gly.psf
-rw-r--r--     1902 2017-11-29 13:55 tests/QS/regtest-admm-dm/2H2O-BLOCKED-NONE_DM.inp
-rw-r--r--     1903 2017-11-29 13:55 tests/QS/regtest-admm-4/2H2O-BLOCKED-PURIFY-BLOCKED.inp
-rw-r--r--     1914 2017-11-29 13:55 tests/QS/regtest-admm-4/2H2O-BLOCKED-PURIFY-FULL.inp
-rw-r--r--     1899 2017-11-29 13:55 tests/QS/regtest-admm-4/2H2O-BLOCKED-PURIFY-OFF.inp
-rw-r--r--     1278 2010-10-26 17:49 tests/QS/untested_inputs/2H2O_bsse.inp
-rw-r--r--     1292 2015-05-21 08:59 tests/QS/regtest-gpw-3/2H2O_bsse.inp
-rw-r--r--     1390 2015-05-21 08:59 tests/QS/regtest-gpw-3/2H2O_bsse_r.inp
-rw-r--r--      875 2015-05-21 08:59 tests/SE/regtest-2-2/2h2o_disp1.inp
-rw-r--r--      913 2015-05-21 08:59 tests/SE/regtest-2-2/2h2o_disp2.inp
-rw-r--r--     1068 2015-05-21 08:59 tests/SE/regtest-2-2/2h2o_disp3.inp
...

A hint: In order to limit the size of this page, in total 5867 archive member files - probably not "information" or "documentation" related - are omitted here. But all those files can be found in the complete docs-related index file or in the originally, by date, by pathname, by filename or by file extension sorted index files (roughly file size each: 1.2 MB).
   MD5 (cp2k-6.1.tar.bz2): 573a4de5a0ee2aaabb213e04543cb10f
  SHA1 (cp2k-6.1.tar.bz2): 450533fdb738300c675d0b354678e0ef7020f11e
SHA256 (cp2k-6.1.tar.bz2): af803558e0a6b9e9d9ce8a3ab955ba32bacd179922455424e061c82c9fefa34b

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