| Port details |
- dftd4 Atomic-charge dependent london dispersion correction computation
- 3.7.0_1 science
 =2      3.7.0Version of this port present on the latest quarterly branch. - Maintainer: yuri@FreeBSD.org
- Port Added: 2022-01-04 20:27:16
- Last Update: 2025-01-28 16:42:55
- Commit Hash: e54e2c6
- People watching this port, also watch:: jdictionary, py311-Automat, py311-python-gdsii, py39-PyOpenGL, p5-Sane
- License: GPLv3
- WWW:
- https://www.chemie.uni-bonn.de/pctc/mulliken-center/software/dftd4/
- Description:
- D4 is a generally applicable atomic-charge dependent london dispersion
correction calculator.
  ¦  ¦  ¦  ¦ 
- Manual pages:
- FreshPorts has no man page information for this port.
- pkg-plist: as obtained via:
make generate-plist - Dependency lines:
-
- To install the port:
- cd /usr/ports/science/dftd4/ && make install clean
- To add the package, run one of these commands:
- pkg install science/dftd4
- pkg install dftd4
NOTE: If this package has multiple flavors (see below), then use one of them instead of the name specified above.- PKGNAME: dftd4
- Flavors: there is no flavor information for this port.
- distinfo:
- TIMESTAMP = 1725080870
SHA256 (dftd4-dftd4-v3.7.0_GH0.tar.gz) = f00b244759eff2c4f54b80a40673440ce951b6ddfa5eee1f46124297e056f69c
SIZE (dftd4-dftd4-v3.7.0_GH0.tar.gz) = 388657
Packages (timestamps in pop-ups are UTC):
- Dependencies
- NOTE: FreshPorts displays only information on required and default dependencies. Optional dependencies are not covered.
- Build dependencies:
-
- mstore>0 : science/mstore
- cmake : devel/cmake-core
- gfortran13 : lang/gcc13
- as : devel/binutils
- Runtime dependencies:
-
- gfortran13 : lang/gcc13
- Library dependencies:
-
- libmctc-lib.so : science/mctc-lib
- libmulticharge.so : science/multicharge
- libopenblas.so : math/openblas
- This port is required by:
- for Libraries
-
- science/py-dftd4
- science/tblite
Configuration Options:- No options to configure
- Options name:
- science_dftd4
- USES:
- cmake:testing fortran
- FreshPorts was unable to extract/find any pkg message
- Master Sites:
|
| Commit History - (may be incomplete: for full details, see links to repositories near top of page) |
| Commit | Credits | Log message |
|---|
3.7.0_1
28 Jan 2025 16:42:55
 |
Thierry Thomas (thierry) |
*/*: bump PORTREVISION after OpenBLAS upgrade
Remark: this souldn’t be necessary, because the version of the library is the
same, but due to many changes between these releases, it is safer this way.
PR: 284314 |
3.7.0
31 Aug 2024 07:16:14
|
Yuri Victorovich (yuri) |
science/{,py-}dftd4: update 3.6.0 → 3.7.0
Reported by: portscout |
3.6.0_1
21 Jun 2024 17:49:24
|
Thierry Thomas (thierry) |
*/*: bump PORTREVISION after the upgrade to OpenBLAS |
3.6.0
21 Apr 2024 22:18:41
|
Yuri Victorovich (yuri)
Author: Andrey Korobkov |
science/{,py-}dftd4: update 3.5.0 → 3.6.0
PR: 278516 |
3.5.0_1
12 Dec 2023 19:03:50
|
Thierry Thomas (thierry) |
*/*: bump PORTREVISION after the upgrade of OpenBLAS
PR: 273219 |
3.5.0
03 Aug 2023 10:40:00
|
Piotr Kubaj (pkubaj) |
science/dftd4: remove stale powerpc* lines |
3.5.0
03 Aug 2023 07:02:07
|
Yuri Victorovich (yuri) |
science/dftd4: Correct pkg-descr |
3.5.0
18 Jun 2023 18:43:47
|
Yuri Victorovich (yuri) |
science/dftd4: Update 3.4.0 → 3.5.0
Reported by: portscout |
3.4.0_1
23 Apr 2023 09:09:58
|
Gerald Pfeifer (gerald) |
*: Bump PORTREVISIONs for math/mpc update to 1.3.1 |
3.4.0
21 Dec 2022 07:13:58
|
Yuri Victorovich (yuri) |
*/*: Limit BROKEN statement for missing ieee_arithmetic.mod feature on
powerpc64*
... to only systems where it isn't yet enabled.
Reported by: pkubaj@ |
3.4.0
20 Dec 2022 06:54:24
|
Yuri Victorovich (yuri) |
science/dftd4: Broken on powerpc64 and powerpc64le
Reported by: fallout |
07 Sep 2022 21:58:51
|
Stefan Eßer (se) |
Remove WWW entries moved into port Makefiles
Commit b7f05445c00f has added WWW entries to port Makefiles based on
WWW: lines in pkg-descr files.
This commit removes the WWW: lines of moved-over URLs from these
pkg-descr files.
Approved by: portmgr (tcberner) |
3.4.0
07 Sep 2022 21:10:59
|
Stefan Eßer (se) |
Add WWW entries to port Makefiles
It has been common practice to have one or more URLs at the end of the
ports' pkg-descr files, one per line and prefixed with "WWW:". These
URLs should point at a project website or other relevant resources.
Access to these URLs required processing of the pkg-descr files, and
they have often become stale over time. If more than one such URL was
present in a pkg-descr file, only the first one was tarnsfered into
the port INDEX, but for many ports only the last line did contain the
port specific URL to further information.
There have been several proposals to make a project URL available as
a macro in the ports' Makefiles, over time.
(Only the first 15 lines of the commit message are shown above  ) |
3.4.0
30 Apr 2022 19:48:30
|
Yuri Victorovich (yuri) |
science/dftd4: Update 3.3.0 -> 3.4.0
Reported by: portscout |
3.3.0_1
20 Mar 2022 19:20:21
|
Yuri Victorovich (yuri) |
science/dftd4: Broken on aarch64
Reported by: portscout |
3.3.0_1
18 Jan 2022 20:12:05
|
Yuri Victorovich (yuri) |
*/*: In 7 ports remove GNU-10.3.0 from install paths
This makes them prone to breaking when GCC version is changed.
Reported by: diizzy@ |
3.3.0
04 Jan 2022 20:23:11
|
Yuri Victorovich (yuri) |
science/dftd4: New port: Atomic-charge dependent london dispersion correction
computation |
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