notbugAs an Amazon Associate I earn from qualifying purchases.
Want a good read? Try FreeBSD Mastery: Jails (IT Mastery Book 15)
Want a good monitor light? See my photosAll times are UTC
Ukraine

Bot filter coming soon

To deter bots pegging the database CPU to 100%, a bot testing filter to be added to the website. This should not affect newsfeeds etc. Anubis seems light-weight - it is already in use within the FreeBSD Project. This notice is just a heads up in case you see something odd. This notice will be updated after Anubis is installed.

Port details on branch 2022Q2
atompaw Tool for projector augmented wave functions for molecular simulations
4.2.0.3_2 science on this many watch lists=2 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 4.2.0.3_2Version of this port present on the latest quarterly branch.
Maintainer: yuri@FreeBSD.org search for ports maintained by this maintainer
Port Added: 2018-06-14 05:53:10
Last Update: 2025-01-24 12:18:28
Commit Hash: 6cce1f5
People watching this port, also watch:: jdictionary, py311-Automat, py311-python-gdsii, py311-PyOpenGL, p5-Sane
License: GPLv3
WWW:
https://users.wfu.edu/natalie/papers/pwpaw/
Description:
atompaw is a tool to generate projector and basis functions needed for performing electronic structure calculations based on the projector augmented wave (PAW) method. PAW method is based on the publication http://www.sciencedirect.com/science/article/pii/S0370157300000077
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 (5 items)
Collapse this list.
  1. bin/atompaw
  2. bin/graphatom
  3. /usr/local/share/licenses/atompaw-4.2.0.3_2/catalog.mk
  4. /usr/local/share/licenses/atompaw-4.2.0.3_2/LICENSE
  5. /usr/local/share/licenses/atompaw-4.2.0.3_2/GPLv3
Collapse this list.
Dependency lines:
  • atompaw>0:science/atompaw
To install the port:
cd /usr/ports/science/atompaw/ && make install clean
To add the package, run one of these commands:
  • pkg install science/atompaw
  • pkg install atompaw
NOTE: If this package has multiple flavors (see below), then use one of them instead of the name specified above.
PKGNAME: atompaw
Flavors: there is no flavor information for this port.
distinfo:
TIMESTAMP = 1690356331 SHA256 (atompaw-4.2.0.3.tar.gz) = 9fd4f9b60e793eee10aead4296e89f0bd6e8612b729a15e2401bbd90e4e9dd2d SIZE (atompaw-4.2.0.3.tar.gz) = 5824502

Packages (timestamps in pop-ups are UTC):
atompaw
ABIaarch64amd64armv6armv7i386powerpcpowerpc64powerpc64le
FreeBSD:13:latest4.2.0.3_24.2.0.3_24.1.0.6_14.2.0.3_24.2.0.3_2-4.1.0.6_1-
FreeBSD:13:quarterly4.2.0.3_24.2.0.3_2-4.2.0.3_24.2.0.3_2-4.2.0.3_14.2.0.3_1
FreeBSD:14:latest4.2.0.3_24.2.0.3_2-4.2.0.3_24.2.0.3_2---
FreeBSD:14:quarterly4.2.0.3_24.2.0.3_2-4.2.0.3_24.2.0.3_2-4.2.0.3_14.2.0.3_1
FreeBSD:15:latest4.2.0.3_24.2.0.3_2n/a4.2.0.3_2n/a-4.2.0.3_14.2.0.3_1
Dependencies
NOTE: FreshPorts displays only information on required and default dependencies. Optional dependencies are not covered.
Build dependencies:
  1. gfortran13 : lang/gcc13
  2. gmake>=4.4.1 : devel/gmake
  3. as : devel/binutils
Runtime dependencies:
  1. gfortran13 : lang/gcc13
Library dependencies:
  1. liblapack.so : math/lapack
  2. libblas.so : math/blas
  3. libxc.so : science/libxc
This port is required by:
for Run
  1. science/abinit

Configuration Options:
===> The following configuration options are available for atompaw-4.2.0.3_2: DOCS=on: Build and/or install documentation LIBXC=on: Build with libxc ===> Use 'make config' to modify these settings
Options name:
science_atompaw
USES:
fortran gmake libtool
FreshPorts was unable to extract/find any pkg message
Master Sites:
Expand this list (1 items)
Collapse this list.
  1. http://users.wfu.edu/natalie/papers/pwpaw/
Collapse this list.

There are no commits on branch 2022Q2 for this port