Пакет: openmx (3.8.5+dfsg1-1)

[ Източник: openmx  ]

package for nano-scale material simulations

OpenMX (Open source package for Material eXplorer) is a program package for nano-scale material simulations based on density functional theories (DFT), norm-conserving pseudopotentials and pseudo-atomic localized basis functions. Since the code is designed for the realization of large-scale ab initio calculations on parallel computers, it is anticipated that OpenMX can be a useful and powerful tool for nano-scale material sciences in a wide variety of systems such as biomaterials, carbon nanotubes, magnetic materials, and nanoscale conductors.

Етикети: Field: Chemistry, Physics

Други пакети, свързани с openmx

• dep: libblas3

  Basic Linear Algebra Reference implementations, shared library

  или libblas.so.3

  виртуален пакет, предлаган от libatlas3-base, libblas3, libblis2-openmp, libblis2-pthread, libblis2-serial, libopenblas-base

• dep: libc6 (>= 2.14) [amd64]

  GNU C Library: Shared libraries
  също и виртуален пакет, предлаган от libc6-udeb

  dep: libc6 (>= 2.17) [arm64]

  dep: libc6 (>= 2.7) [armhf, i386]

• dep: libfftw3-double3 (>= 3.3.5)

  Library for computing Fast Fourier Transforms - Double precision

• dep: libgcc1 (>= 1:4.0) [amd64, armhf]

  GCC support library

  dep: libgcc1 (>= 1:4.2) [arm64, i386]

• dep: libgfortran5 (>= 8)

  Runtime library for GNU Fortran applications

• dep: libgomp1 (>= 4.9)

  GCC OpenMP (GOMP) support library

• dep: liblapack3

  Library of linear algebra routines 3 - shared version

  или liblapack.so.3

  виртуален пакет, предлаган от libatlas3-base, liblapack3, libopenblas-base

• dep: libopenmpi3

  high performance message passing library -- shared library

• dep: libquadmath0 (>= 4.6) [amd64, i386]

  GCC Quad-Precision Math Library

• rec: openmx-data

  package for nano-scale material simulations (data)

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Архитектура	Големина на пакета	Големина след инсталиране	Файлове
amd64	1 339,6 кБ	4 383,0 кБ	[списък на файловете]
arm64	1 202,4 кБ	3 991,0 кБ	[списък на файловете]
armhf	1 234,3 кБ	3 419,0 кБ	[списък на файловете]
i386	1 329,1 кБ	4 803,0 кБ	[списък на файловете]