# 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 | 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

- diff from 8.8.4-2 to 8.10.2-2 (65.5 MiB)

No changes file available.

## Binary packages built by this source

- abinit: package for electronic structure calculations
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 executables needed to perform calculations (however,

pseudopotentials are not supplied). For a set of pseudopotentials, install

the abinit-data package.

- 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.