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Port details
chemps2 Spin-adapted implementation of DMRG for ab initio quantum chemistry
1.8.10 science on this many watch lists=0 search for ports that depend on this port Find issues related to this port Report an issue related to this port View this port on Repology. pkg-fallout 1.8.10Version of this port present on the latest quarterly branch.
Maintainer: yuri@FreeBSD.org search for ports maintained by this maintainer
Port Added: 2017-11-23 05:58:58
Last Update: 2021-04-07 08:09:01
Commit Hash: cf118cc
License: GPLv2
Description:
SVNWeb : git : Homepage
pkg-plist: as obtained via: make generate-plist
Expand this list (65 items)
Collapse this list.
  1. @ldconfig
  2. /usr/local/share/licenses/CheMPS2-1.8.10/catalog.mk
  3. /usr/local/share/licenses/CheMPS2-1.8.10/LICENSE
  4. /usr/local/share/licenses/CheMPS2-1.8.10/GPLv2
  5. bin/chemps2
  6. include/chemps2/CASPT2.h
  7. include/chemps2/CASSCF.h
  8. include/chemps2/ConjugateGradient.h
  9. include/chemps2/ConvergenceScheme.h
  10. include/chemps2/Correlations.h
  11. include/chemps2/Cumulant.h
  12. include/chemps2/DIIS.h
  13. include/chemps2/DMRG.h
  14. include/chemps2/DMRGSCFindices.h
  15. include/chemps2/DMRGSCFintegrals.h
  16. include/chemps2/DMRGSCFmatrix.h
  17. include/chemps2/DMRGSCFoptions.h
  18. include/chemps2/DMRGSCFrotations.h
  19. include/chemps2/DMRGSCFunitary.h
  20. include/chemps2/DMRGSCFwtilde.h
  21. include/chemps2/Davidson.h
  22. include/chemps2/EdmistonRuedenberg.h
  23. include/chemps2/Excitation.h
  24. include/chemps2/FCI.h
  25. include/chemps2/FourIndex.h
  26. include/chemps2/Hamiltonian.h
  27. include/chemps2/Heff.h
  28. include/chemps2/Initialize.h
  29. include/chemps2/Irreps.h
  30. include/chemps2/Lapack.h
  31. include/chemps2/MPIchemps2.h
  32. include/chemps2/Molden.h
  33. include/chemps2/Options.h
  34. include/chemps2/Problem.h
  35. include/chemps2/Sobject.h
  36. include/chemps2/Special.h
  37. include/chemps2/SyBookkeeper.h
  38. include/chemps2/Tensor.h
  39. include/chemps2/Tensor3RDM.h
  40. include/chemps2/TensorF0.h
  41. include/chemps2/TensorF1.h
  42. include/chemps2/TensorGYZ.h
  43. include/chemps2/TensorKM.h
  44. include/chemps2/TensorL.h
  45. include/chemps2/TensorO.h
  46. include/chemps2/TensorOperator.h
  47. include/chemps2/TensorQ.h
  48. include/chemps2/TensorS0.h
  49. include/chemps2/TensorS1.h
  50. include/chemps2/TensorT.h
  51. include/chemps2/TensorX.h
  52. include/chemps2/ThreeDM.h
  53. include/chemps2/TwoDM.h
  54. include/chemps2/TwoIndex.h
  55. include/chemps2/Wigner.h
  56. lib/libchemps2.so
  57. lib/libchemps2.so.3
  58. share/cmake/CheMPS2/CheMPS2Config.cmake
  59. share/cmake/CheMPS2/CheMPS2ConfigVersion.cmake
  60. share/cmake/CheMPS2/CheMPS2Targets-shared-release.cmake
  61. share/cmake/CheMPS2/CheMPS2Targets-shared.cmake
  62. share/cmake/CheMPS2/FindTargetHDF5.cmake
  63. @owner
  64. @group
  65. @mode
Collapse this list.
Dependency lines:
  • For RUN/BUILD depends:
    • CheMPS2>0:science/chemps2
  • For LIB depends:
    • libchemps2.so:science/chemps2
To install the port: cd /usr/ports/science/chemps2/ && make install clean
To add the package, run one of these commands:
  • pkg install science/chemps2
  • pkg install CheMPS2
PKGNAME: CheMPS2
Flavors: there is no flavor information for this port.
distinfo:
Packages (timestamps in pop-ups are UTC):
CheMPS2
ABIlatestquarterly
FreeBSD:11:aarch641.8.7_21.8.9_6
FreeBSD:11:amd641.8.101.8.10
FreeBSD:11:armv6--
FreeBSD:11:i3861.8.101.8.10
FreeBSD:11:mips--
FreeBSD:11:mips64--
FreeBSD:12:aarch641.8.81.8.10
FreeBSD:12:amd641.8.101.8.10
FreeBSD:12:armv61.8.8-
FreeBSD:12:armv7--
FreeBSD:12:i3861.8.101.8.10
FreeBSD:12:mips--
FreeBSD:12:mips64--
FreeBSD:12:powerpc64-1.8.10
FreeBSD:13:aarch641.8.9_61.8.10
FreeBSD:13:amd641.8.101.8.10
FreeBSD:13:armv61.8.9_6-
FreeBSD:13:armv71.8.9_6-
FreeBSD:13:i3861.8.101.8.10
FreeBSD:13:mips--
FreeBSD:13:mips64--
FreeBSD:13:powerpc641.8.9_6-
FreeBSD:14:aarch641.8.10-
FreeBSD:14:amd641.8.10-
FreeBSD:14:armv6--
FreeBSD:14:armv7--
FreeBSD:14:i3861.8.10-
FreeBSD:14:mips--
FreeBSD:14:mips64--
FreeBSD:14:powerpc641.8.10-
 

Dependencies
NOTE: FreshPorts displays only information on required and default dependencies. Optional dependencies are not covered.
Build dependencies:
  1. cmake : devel/cmake
  2. gfortran10 : lang/gcc10
  3. as : devel/binutils
Runtime dependencies:
  1. gfortran10 : lang/gcc10
Library dependencies:
  1. libhdf5.so : science/hdf5
  2. libsz.so : science/szip
  3. libopenblas.so : math/openblas
There are no ports dependent upon this port

Configuration Options:
Options name:

USES:

FreshPorts was unable to extract/find any pkg message
Master Sites:
Expand this list (1 items)
Collapse this list.
  1. https://codeload.github.com/SebWouters/CheMPS2/tar.gz/v1.8.10?dummy=/
Collapse this list.

Number of commits found: 19

Commit History - (may be incomplete: see SVNWeb link above for full details)
DateByDescription
07 Apr 2021 08:09:01
 files touched by this commit commit hash:cf118ccf875508b9a1c570044c93cfcc82bd455c  1.8.10
mat search for other commits by this committer
One more small cleanup, forgotten yesterday.
Reported by:	lwhsu
06 Apr 2021 14:31:07
 files touched by this commit commit hash:305f148f482daf30dcf728039d03d019f88344eb  1.8.10
mat search for other commits by this committer
Remove # $FreeBSD$ from Makefiles.
01 Feb 2021 09:53:54
Original commit files touched by this commit Revision:563561  1.8.10
yuri search for other commits by this committer
science/chemps2: Update 1.8.9 -> 1.8.10

PR:		252969
06 May 2020 16:39:12
Original commit files touched by this commit Revision:534190  1.8.9_6
yuri search for other commits by this committer
Bump 37 ports depending on math/openblas through USES=blaslapack:openblas
because after the recent math/openblas update the library name changed in
openblas
30 Jan 2020 14:17:44
Original commit files touched by this commit Revision:524642  1.8.9_5
swills search for other commits by this committer
Fix math/openblas and bump dependent ports

* Fix build on i386 [1]
* Fix science/code_saturne build with new openblas [2]
* Avoid installing private headers [3]
* Prevent build from optimizing for host by correcting build confg [4]
* Bump portrevision of dependent ports [5]

This is correcting issues from r523749 [1][2][4] and r515970 [3]

PR:		231371
Reported by:	build cluster [1]
Reported by:	Dima Pasechnik <dimpase+freebsd@gmail.com> [2]
Reported by:	many [5]
Reviewed by:	mat, bapt
Approved by:	implicit, since this is a build fix
26 Jul 2019 20:46:57
Original commit files touched by this commit Revision:507372  1.8.9_4
gerald search for other commits by this committer
Bump PORTREVISION for ports depending on the canonical version of GCC
as defined in Mk/bsd.default-versions.mk which has moved from GCC 8.3
to GCC 9.1 under most circumstances now after revision 507371.

This includes ports
 - with USE_GCC=yes or USE_GCC=any,
 - with USES=fortran,
 - using Mk/bsd.octave.mk which in turn features USES=fortran, and
 - with USES=compiler specifying openmp, nestedfct, c11, c++0x, c++11-lang,
   c++11-lib, c++14-lang, c++17-lang, or gcc-c++11-lib
plus, everything INDEX-11 shows with a dependency on lang/gcc9 now.

PR:		238330
22 Apr 2019 13:16:34
Original commit files touched by this commit Revision:499638  1.8.9_3
gerald search for other commits by this committer
Related to revision 499061 bump ports with USES=fortran to have them
benefit from the improved situation where libgcc_s is only used when
absolutely necessary.

Suggested by:	tijl
05 Jan 2019 22:46:54
Original commit files touched by this commit Revision:489412  1.8.9_2
sunpoet search for other commits by this committer
Update science/hdf5 to 1.10.4

- Bump PORTREVISION of dependent ports for shlib change

Changes:	https://portal.hdfgroup.org/display/support/HDF5%201.10.4#releasenotes
PR:		233070
Submitted by:	wen
25 Dec 2018 20:25:40
Original commit files touched by this commit Revision:488341  1.8.9_1
tcberner search for other commits by this committer
Change cmake default behaviour to outsource.

Ports that build out of source now simply can use "USES=cmake"
instead of "USES=cmake:outsource". Ports that fail to build
out of source now need to specify "USES=cmake:insource".

I tried to only set insource where explictely needed.

PR:		232038
Exp-run by:	antoine
12 Dec 2018 01:35:36
Original commit files touched by this commit Revision:487272  1.8.9_1
gerald search for other commits by this committer
Bump PORTREVISION for ports depending on the canonical version of GCC
defined via Mk/bsd.default-versions.mk which has moved from GCC 7.4 t
GCC 8.2 under most circumstances.

This includes ports
 - with USE_GCC=yes or USE_GCC=any,
 - with USES=fortran,
 - using Mk/bsd.octave.mk which in turn features USES=fortran, and
 - with USES=compiler specifying openmp, nestedfct, c11, c++0x, c++11-lang,
   c++11-lib, c++14-lang, c++17-lang, or gcc-c++11-lib
plus, as a double check, everything INDEX-11 showed depending on lang/gcc7.

PR:		231590
30 Oct 2018 06:00:05
Original commit files touched by this commit Revision:483452  1.8.9
yuri search for other commits by this committer
science/chemps2: Update 1.8.8 -> 1.8.9

Reported by:	portscout
28 Sep 2018 03:25:20
Original commit files touched by this commit Revision:480839  1.8.8
yuri search for other commits by this committer
science/chemps2: Update 1.8.7 -> 1.8.8

Reported by:	portscout
05 Sep 2018 22:05:23
Original commit files touched by this commit Revision:479046  1.8.7_2
sunpoet search for other commits by this committer
Update science/hdf5 to 1.10.2

- Bump PORTREVISION of dependent ports for shlib change

Changes:	https://portal.hdfgroup.org/display/support/HDF5%201.10.2#releasenotes
		https://support.hdfgroup.org/ftp/HDF5/releases/hdf5-1.10/hdf5-1.10.2/src/hdf5-1.10.2-RELEASE.txt
PR:		231009
Exp-run by:	antoine
29 Jul 2018 22:18:46
Original commit files touched by this commit Revision:475857  1.8.7_1
gerald search for other commits by this committer
Bump PORTREVISION for ports depending on the canonical version of GCC
in the ports tree (via Mk/bsd.default-versions.mk and lang/gcc) which
has now moved from GCC 6 to GCC 7 by default.

This includes ports
 - featuring USE_GCC=yes or USE_GCC=any,
 - featuring USES=fortran,
 - using Mk/bsd.octave.mk which in turn features USES=fortran, and those
 - with USES=compiler specifying one of openmp, nestedfct, c11, c++0x,
   c++11-lib, c++11-lang, c++14-lang, c++17-lang, or gcc-c++11-lib.

PR:		222542
26 Mar 2018 09:47:56
Original commit files touched by this commit Revision:465573  1.8.7
yuri search for other commits by this committer
science/chemps2: Update 1.8.6 -> 1.8.7

Reported by:	portscout
17 Mar 2018 17:15:22
Original commit files touched by this commit Revision:464835  1.8.6
yuri search for other commits by this committer
science/chemps2: Update to 1.8.6

Also add USE_LDCONFIG=yes

Reported by:	portscout
10 Mar 2018 17:46:06
Original commit files touched by this commit Revision:464084  1.8.5_1
gerald search for other commits by this committer
Bump PORTREVISIONs of all users of math/mpc that we just updated to
version 1.1.0 (via revision 464079).
15 Jan 2018 22:04:40
Original commit files touched by this commit Revision:459125  1.8.5
yuri search for other commits by this committer
science/chemps2: Update to 1.8.5

Submitted by:	myself
Reported by:	portscout
Approved by:	tcberner (mentor)
Differential Revision:	https://reviews.freebsd.org/D13908
23 Nov 2017 05:58:51
Original commit files touched by this commit Revision:454740  1.8.4.12
yuri search for other commits by this committer
New port: science/chemps2: Spin-adapted implementation of DMRG for ab initio
quantum chemistry

Approved by:	tcberner (mentor)
Differential Revision:	https://reviews.freebsd.org/D13100

Number of commits found: 19