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Port details
latte Quantum chemistry: Density functional tight binding molecular dynamics
1.2.2_4 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 1.2.2_3Version of this port present on the latest quarterly branch.
Maintainer: yuri@FreeBSD.org search for ports maintained by this maintainer
Port Added: 2018-10-31 23:08:04
Last Update: 2024-02-18 09:29:31
Commit Hash: 9eba616
License: GPLv3
WWW:
https://github.com/lanl/LATTE
Description:
A molecular dynamics package based around self-consistent-charge density functional tight binding theory. Features: * Forces computed at the SCC-DFTB level. * Provides forces and the potential component of the total energy. * Integrates the electronic degrees of freedom (XL) (provides charges). * Solves the electronic structure of the system. * Several solvers such as SP2, Truncated SP2, Chebyshev polynomial expansion, etc.
Homepage    cgit ¦ Codeberg ¦ GitHub ¦ GitLab ¦ SVNWeb

Manual pages:
FreshPorts has no man page information for this port.
pkg-plist: as obtained via: make generate-plist
Expand this list (13 items)
Collapse this list.
  1. bin/LATTE_MPI_DOUBLE
  2. @ldconfig
  3. /usr/local/share/licenses/latte-1.2.2_4/catalog.mk
  4. /usr/local/share/licenses/latte-1.2.2_4/LICENSE
  5. /usr/local/share/licenses/latte-1.2.2_4/GPLv3
  6. lib/cmake/LATTE/LATTEConfig.cmake
  7. lib/cmake/LATTE/LATTEConfigVersion.cmake
  8. lib/cmake/LATTE/LATTE_Targets-release.cmake
  9. lib/cmake/LATTE/LATTE_Targets.cmake
  10. lib/liblatte.so
  11. @owner
  12. @group
  13. @mode
Collapse this list.
Dependency lines:
  • latte>0:science/latte
Conflicts:
CONFLICTS_INSTALL:
  • latte-integrale
Conflicts Matches:
There are no Conflicts Matches for this port. This is usually an error.
To install the port:
cd /usr/ports/science/latte/ && make install clean
To add the package, run one of these commands:
  • pkg install science/latte
  • pkg install latte
NOTE: If this package has multiple flavors (see below), then use one of them instead of the name specified above.
PKGNAME: latte
Flavors: there is no flavor information for this port.
distinfo:
TIMESTAMP = 1588782384 SHA256 (lanl-LATTE-v1.2.2_GH0.tar.gz) = b54d62676a4a9355f5698823b86866640afd707137dfbdcfbf8832ffc75b9b35 SIZE (lanl-LATTE-v1.2.2_GH0.tar.gz) = 6692423

Packages (timestamps in pop-ups are UTC):
latte
ABIaarch64amd64armv6armv7i386powerpcpowerpc64powerpc64le
FreeBSD:13:latest-1.2.2_4-1.2.2_41.2.2_4---
FreeBSD:13:quarterly-1.2.2_3-1.2.2_31.2.2_3---
FreeBSD:14:latest-1.2.2_4-1.2.2_41.2.2_4---
FreeBSD:14:quarterly-1.2.2_3-1.2.2_31.2.2_3---
FreeBSD:15:latest-1.2.2_4n/a1.2.2_3n/a---
FreeBSD:15:quarterly--n/a-n/a---
Dependencies
NOTE: FreshPorts displays only information on required and default dependencies. Optional dependencies are not covered.
Build dependencies:
  1. cmake : devel/cmake-core
  2. gfortran12 : lang/gcc12
  3. as : devel/binutils
Runtime dependencies:
  1. gfortran12 : lang/gcc12
Library dependencies:
  1. libmpi_cxx.so : net/openmpi4
  2. libopenblas.so : math/openblas
This port is required by:
for Libraries
  1. science/lammps

Configuration Options:
===> The following configuration options are available for latte-1.2.2_4: DBCSR=off: Use distributed block compressed sparse row matrix library MPI=on: MPI (Message Passing Interface) support OPENMP=on: Parallel processing support via OpenMP ===> Use 'make config' to modify these settings
Options name:
science_latte
USES:
blaslapack:openblas cmake:noninja fortran shebangfix
FreshPorts was unable to extract/find any pkg message
Master Sites:
Expand this list (1 items)
Collapse this list.
  1. https://codeload.github.com/lanl/LATTE/tar.gz/v1.2.2?dummy=/
Collapse this list.

Number of commits found: 23

Commit History - (may be incomplete: for full details, see links to repositories near top of page)
CommitCreditsLog message
1.2.2_4
18 Feb 2024 09:29:31
commit hash: 9eba6162f8f63de2b89ae35eef90e7c296f2373acommit hash: 9eba6162f8f63de2b89ae35eef90e7c296f2373acommit hash: 9eba6162f8f63de2b89ae35eef90e7c296f2373acommit hash: 9eba6162f8f63de2b89ae35eef90e7c296f2373a files touched by this commit
Thierry Thomas (thierry) search for other commits by this committer
*/*: bump PORTREVISION after OpenMPI upgrade
1.2.2_3
18 Feb 2024 09:22:35
commit hash: a62b21d98ac3a81da7047e4f6c3cc97b28c4a955commit hash: a62b21d98ac3a81da7047e4f6c3cc97b28c4a955commit hash: a62b21d98ac3a81da7047e4f6c3cc97b28c4a955commit hash: a62b21d98ac3a81da7047e4f6c3cc97b28c4a955 files touched by this commit
Thierry Thomas (thierry) search for other commits by this committer
*/*: fix the dependency to net/openmpi4

For ports without USES=mpi:openmpi. For the others, it will be set
automatically.
1.2.2_3
12 Dec 2023 19:03:50
commit hash: ab1713728d621e7b57d276ef27de37a8754e6ee0commit hash: ab1713728d621e7b57d276ef27de37a8754e6ee0commit hash: ab1713728d621e7b57d276ef27de37a8754e6ee0commit hash: ab1713728d621e7b57d276ef27de37a8754e6ee0 files touched by this commit
Thierry Thomas (thierry) search for other commits by this committer
*/*: bump PORTREVISION after the upgrade of OpenBLAS

PR:		273219
1.2.2_2
23 Apr 2023 09:09:58
commit hash: 8d3e020ed032a8db00208994d0db646de7dc6f5bcommit hash: 8d3e020ed032a8db00208994d0db646de7dc6f5bcommit hash: 8d3e020ed032a8db00208994d0db646de7dc6f5bcommit hash: 8d3e020ed032a8db00208994d0db646de7dc6f5b files touched by this commit
Gerald Pfeifer (gerald) search for other commits by this committer
*: Bump PORTREVISIONs for math/mpc update to 1.3.1
07 Sep 2022 21:58:51
commit hash: fb16dfecae4a6efac9f3a78e0b759fb7a3c53de4commit hash: fb16dfecae4a6efac9f3a78e0b759fb7a3c53de4commit hash: fb16dfecae4a6efac9f3a78e0b759fb7a3c53de4commit hash: fb16dfecae4a6efac9f3a78e0b759fb7a3c53de4 files touched by this commit
Stefan Eßer (se) search for other commits by this committer
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)
1.2.2_1
07 Sep 2022 21:10:59
commit hash: b7f05445c00f2625aa19b4154ebcbce5ed2daa52commit hash: b7f05445c00f2625aa19b4154ebcbce5ed2daa52commit hash: b7f05445c00f2625aa19b4154ebcbce5ed2daa52commit hash: b7f05445c00f2625aa19b4154ebcbce5ed2daa52 files touched by this commit
Stefan Eßer (se) search for other commits by this committer
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 View all of this commit message)
1.2.2_1
02 Sep 2022 15:31:20
commit hash: bb57bb9f69e7720f3758b4262dcdcc4490b14969commit hash: bb57bb9f69e7720f3758b4262dcdcc4490b14969commit hash: bb57bb9f69e7720f3758b4262dcdcc4490b14969commit hash: bb57bb9f69e7720f3758b4262dcdcc4490b14969 files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
math/dbcsr: Update 2.3.0 -> 2.4.1

Reported by:	portscout
1.2.2
07 Apr 2021 08:09:01
commit hash: cf118ccf875508b9a1c570044c93cfcc82bd455ccommit hash: cf118ccf875508b9a1c570044c93cfcc82bd455ccommit hash: cf118ccf875508b9a1c570044c93cfcc82bd455ccommit hash: cf118ccf875508b9a1c570044c93cfcc82bd455c files touched by this commit
Mathieu Arnold (mat) search for other commits by this committer
One more small cleanup, forgotten yesterday.
Reported by:	lwhsu
1.2.2
06 Apr 2021 14:31:07
commit hash: 305f148f482daf30dcf728039d03d019f88344ebcommit hash: 305f148f482daf30dcf728039d03d019f88344ebcommit hash: 305f148f482daf30dcf728039d03d019f88344ebcommit hash: 305f148f482daf30dcf728039d03d019f88344eb files touched by this commit
Mathieu Arnold (mat) search for other commits by this committer
Remove # $FreeBSD$ from Makefiles.
1.2.2
08 Dec 2020 09:30:36
Revision:557267Original commit files touched by this commit
antoine search for other commits by this committer
Do not include bsd.port.mk twice
1.2.2
17 Nov 2020 22:34:27
Revision:555602Original commit files touched by this commit
linimon search for other commits by this committer
Add workaround for new failure with Fortran GCC 10 frontend:

  Type mismatch between actual argument at (1) and actual argument at (2)
(COMPLEX(8)/REAL(8)).

PR:		246700
Approved by:	maintainer
1.2.2
07 May 2020 01:02:37
Revision:534220Original commit files touched by this commit
yuri search for other commits by this committer
science/latte: Update 1.2.1 -> 1.2.2

Reported by:	portscout
1.2.1_8
19 Apr 2020 09:49:02
Revision:532095Original commit files touched by this commit
danilo search for other commits by this committer
- Update net/openmpi to 4.0.3 (openmpi 1 is deprecated)
- Remove option for net/openmpi2 from science/pnetcdf (net/openmpi2 is
deprecated and will be removed)
- Fix science/gromacs plist when MPI option is enabled
- Bump PORTREVISION for all the consumers of net/openmpi
1.2.1_7
08 Mar 2020 21:56:37
Revision:528082Original commit files touched by this commit
jbeich search for other commits by this committer
Drop dependency on devel/openmp

- Drop if devel/llvm* was used as a substitute

Approved by:	yuri, rene (earlier version)
Differential Revision:	https://reviews.freebsd.org/D23020
1.2.1_6
30 Jan 2020 14:17:44
Revision:524642Original commit files touched by this commit
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
1.2.1_5
21 Sep 2019 18:59:57
Revision:512535Original commit files touched by this commit
jbeich search for other commits by this committer
devel/openmp: update to 9.0.0

- Connect tests to the framework to help QA remaining patches
- Force rebuild all consumers after https://reviews.llvm.org/D59783

Changes:	http://llvm.org/viewvc/llvm-project/openmp/tags/RELEASE_900/final/?view=log
ABI:		https://abi-laboratory.pro/tracker/timeline/llvm_openmp/
1.2.1_4
26 Jul 2019 20:46:57
Revision:507372Original commit files touched by this commit
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
1.2.1_3
08 May 2019 16:05:53
Revision:501030Original commit files touched by this commit
jbeich search for other commits by this committer
devel/openmp: phase out

- Expire after the last version without /usr/lib/libomp.so
- Drop SOVERSION for seamless transition (i.e., avoid conditionals)

PR:		236907
Approved by:	bapt (maintainer)
Differential Revision:	https://reviews.freebsd.org/D19767
1.2.1_2
22 Apr 2019 13:16:34
Revision:499638Original commit files touched by this commit
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
1.2.1_1
25 Dec 2018 20:25:40
Revision:488341Original commit files touched by this commit
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
1.2.1_1
12 Dec 2018 01:35:36
Revision:487272Original commit files touched by this commit
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
1.2.1
06 Dec 2018 05:57:36
Revision:486735Original commit files touched by this commit
yuri search for other commits by this committer
New port: math/latte-integrale: Software for counting lattice points/integration
over convex polytopes
1.2.1
31 Oct 2018 23:05:37
Revision:483624Original commit files touched by this commit
yuri search for other commits by this committer
New port: science/latte: Quantum chemistry: Density functional tight binding
molecular dynamics

Number of commits found: 23