abinit 8.10.2-2 source package in Ubuntu

Changelog

abinit (8.10.2-2) unstable; urgency=medium

  * debian/rules: Set -ffree-line-length-none in DEB_FCFLAGS_MAINT_APPEND and
    do not set FCFLAGS explicitly.
  * debian/tests/control: Require abinit-data, not abinit-examples.
  * debian/tests/control: Require python.
  * debian/patches/testsuite_autopkgtest.patch: New patch, allowing to use a
    system-installed abinit binary.
  * debian/tests/run-unit-test: Update test invocation.

 -- Michael Banck <email address hidden>  Sun, 08 Sep 2019 12:33:37 +0200

Upload details

Uploaded by:
Debichem Team on 2019-09-08
Uploaded to:
Sid
Original maintainer:
Debichem Team
Architectures:
any all
Section:
science
Urgency:
Medium Urgency

See full publishing history Publishing

Series Pocket Published Component Section
Eoan release on 2019-09-09 universe science

Downloads

File Size SHA-256 Checksum
abinit_8.10.2-2.dsc 2.2 KiB 5a33fac37c19582db9f3d52c4684cd71df660c1b7c7200173b9b345a5dc65224
abinit_8.10.2.orig.tar.gz 86.9 MiB b362bda0ccefbc7254d653d551ba1952aa4a92f9f845208caa3446cb8960ad76
abinit_8.10.2-2.debian.tar.xz 12.1 KiB ce69db7f639b874d2cc83be2c85955ce2d4a352d35414b660833be0d541e376c

Available diffs

No changes file available.

Binary packages built by this source

abinit: No summary available for abinit in ubuntu focal.

No description available for abinit in ubuntu focal.

abinit-data: package for electronic structure calculations (Data files)

 ABINIT is a package whose main program allows one to find the total energy,
 charge density and electronic structure of systems made of electrons and
 nuclei (molecules and periodic solids) within Density Functional Theory (DFT),
 using pseudopotentials and a planewave basis.
 .
 ABINIT also includes options to optimize the geometry according to the DFT
 forces and stresses, or to perform molecular dynamics simulations using these
 forces, or to generate dynamical matrices, Born effective charges, and
 dielectric tensors. Excited states can be computed within the Time-Dependent
 Density Functional Theory (for molecules), or within Many-Body Perturbation
 Theory (the GW approximation). In addition to the main ABINIT code, different
 utility programs are provided.
 .
 This package contains a set of pseudopotentials and example inputs.

abinit-dbgsym: debug symbols for abinit
abinit-doc: package for electronic structure calculations (Documentation)

 ABINIT is a package whose main program allows one to find the total energy,
 charge density and electronic structure of systems made of electrons and
 nuclei (molecules and periodic solids) within Density Functional Theory (DFT),
 using pseudopotentials and a planewave basis.
 .
 ABINIT also includes options to optimize the geometry according to the DFT
 forces and stresses, or to perform molecular dynamics simulations using these
 forces, or to generate dynamical matrices, Born effective charges, and
 dielectric tensors. Excited states can be computed within the Time-Dependent
 Density Functional Theory (for molecules), or within Many-Body Perturbation
 Theory (the GW approximation). In addition to the main ABINIT code, different
 utility programs are provided.
 .
 This package contains the documentation and tutorials.