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Port details
dalton Powerful molecular electronic structure program for quantum chemistry
2018.2 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 2018.0Version of this port present on the latest quarterly branch.
Maintainer: yuri@FreeBSD.org search for ports maintained by this maintainer
Port Added: 2018-09-02 07:49:17
Last Update: 2019-08-04 05:22:31
SVN Revision: 508051
License: LGPL21
Description:
SVNWeb : Homepage
pkg-plist: as obtained via: make generate-plist
Expand this list (321 items)
  1. /usr/local/share/licenses/dalton-2018.2/catalog.mk
  2. /usr/local/share/licenses/dalton-2018.2/LICENSE
  3. /usr/local/share/licenses/dalton-2018.2/LGPL21
  4. bin/dalton
  5. bin/dalton.x
  6. share/dalton/GIT_HASH
  7. share/dalton/VERSION
  8. share/dalton/basis/3-21++G
  9. share/dalton/basis/3-21++G*
  10. share/dalton/basis/3-21G
  11. share/dalton/basis/3-21G*
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  15. share/dalton/basis/6-31++G**
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  18. share/dalton/basis/6-311++G(2d,2p)
  19. share/dalton/basis/6-311++G(3df,3pd)
  20. share/dalton/basis/6-311++G**
  21. share/dalton/basis/6-311+G*
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  24. share/dalton/basis/6-311G*
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  28. share/dalton/basis/6-31G*
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  30. share/dalton/basis/ANO-DK3
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  33. share/dalton/basis/Ahlrichs-TZV
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  36. share/dalton/basis/Ahlrichs-pVDZ
  37. share/dalton/basis/Almlof-Taylor-ANO
  38. share/dalton/basis/DZ(Dunning)
  39. share/dalton/basis/DZ+Rydberg(Dunning)
  40. share/dalton/basis/DZP(Dunning)
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  42. share/dalton/basis/DZP+Rydberg(Dunning)
  43. share/dalton/basis/GAMESS-PVTZ
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  65. share/dalton/basis/SVP(Dunning-Hay)
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  67. share/dalton/basis/Sadlej-pVTZ
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  113. share/dalton/basis/aug-cc-pV(5+d)Z
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  240. share/dalton/basis/ecp_data/hay_wadt_mb_n1_ecp
  241. share/dalton/basis/ecp_data/hay_wadt_vdz_n1_ecp
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  252. share/dalton/basis/ecp_data/sbkjc_polarized_p_2d_lfk
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  254. share/dalton/basis/ecp_data/sdb_aug_cc_pvqz
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  311. share/dalton/basis/stuttgart_rlc_ecp
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  314. share/dalton/basis/stuttgart_rsc_segmented_ecp
  315. share/dalton/basis/testbasis
  316. share/dalton/basis/transformformattetBasistoFreeFormat.f90
  317. share/dalton/tools/FChk2HES
  318. share/dalton/tools/aces2dalton
  319. share/dalton/tools/distances
  320. share/dalton/tools/labread
  321. share/dalton/tools/xyz2dalton
Collapse this list.
Dependency lines:
  • dalton>0:science/dalton
To install the port: cd /usr/ports/science/dalton/ && make install clean
To add the package: pkg install dalton
PKGNAME: dalton
Flavors: there is no flavor information for this port.
distinfo:

Dependencies
NOTE: FreshPorts displays only information on required and default dependencies. Optional dependencies are not covered.
Build dependencies:
  1. cmake : devel/cmake
  2. gfortran9 : lang/gcc9
  3. python3.6 : lang/python36
  4. as : devel/binutils
Runtime dependencies:
  1. bash : shells/bash
  2. gfortran9 : lang/gcc9
Library dependencies:
  1. liblapack.so : math/lapack
  2. libopenblas.so : math/openblas
There are no ports dependent upon this port

Configuration Options

USES:

Master Sites:
  1. https://codeload.github.com/dalton/dalton/tar.gz/2018.2?dummy=/
  2. https://gitlab.com/dalton/dalton/repository/4aa945ecd235fbf67ed0c1609617c553ef40be89/archive.tar.gz?dummy=/

Number of commits found: 10

Commit History - (may be incomplete: see SVNWeb link above for full details)
DateByDescription
04 Aug 2019 04:22:31
Original commit files touched by this commit  2018.2
Revision:508051
yuri search for other commits by this committer
science/dalton: Update 2018.0 -> 2018.2

Reported by:	repology
26 Jul 2019 20:46:57
Original commit files touched by this commit  2018.0_2
Revision:507372
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
03 May 2019 13:58:34
Original commit files touched by this commit  2018.0_1
Revision:500732
mat search for other commits by this committer
Fix the a ports that were broken but did not know it.

Differential Revision:	https://reviews.freebsd.org/D20140
22 Apr 2019 13:16:34
Original commit files touched by this commit  2018.0_1
Revision:499638
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
25 Dec 2018 20:25:40
Original commit files touched by this commit  2018.0
Revision:488341
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
17 Dec 2018 04:30:02
Original commit files touched by this commit  2018.0
Revision:487650
yuri search for other commits by this committer
science/dalton: Update 2016.2 -> 2018.0
12 Dec 2018 01:35:36
Original commit files touched by this commit  2016.2_2
Revision:487272
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
04 Nov 2018 18:15:36
Original commit files touched by this commit  2016.2_1
Revision:484118
yuri search for other commits by this committer
science/dalton: Fix build with GCC8

Backport the upstream patch that fixed the issue.

PR:		232959
Reported by:	gerald
02 Sep 2018 07:53:31
Original commit files touched by this commit  2016.2
Revision:478767
yuri search for other commits by this committer
science/dalton: Fix license.
02 Sep 2018 07:49:03
Original commit files touched by this commit  2016.2
Revision:478766
yuri search for other commits by this committer
New port: science/dalton: Powerful molecular electronic structure program for
quantum chemistry

Number of commits found: 10

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mod_perl2Oct 09
xpdfOct 06
xpdf3Oct 06
xpdf4Oct 06
unboundOct 03
cactiOct 02
gitlab-ceOct 02
gitlab-ceOct 02
ruby24Oct 02
ruby25Oct 02
mongodb34Sep 30
mongodb34Sep 30
mongodb36Sep 30

4 vulnerabilities affecting 12 ports have been reported in the past 14 days

* - modified, not new

All vulnerabilities

Last updated:
2019-10-19 10:52:46


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Calculated hourly:
Port count 37693
Broken 79
Deprecated 102
Ignore 344
Forbidden 3
Restricted 156
No CDROM 73
Vulnerable 26
Expired 18
Set to expire 73
Interactive 0
new 24 hours 0
new 48 hours0
new 7 days19
new fortnight58
new month224

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