Package: openmx (3.8.5+dfsg1-1)

[ Source: 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.

Tags: Field: Chemistry, Physics

Other Packages Related to openmx

• dep: libblas3

  Basic Linear Algebra Reference implementations, shared library

  or libblas.so.3

  virtual package provided by libatlas3-base, libblas3, libblis4-openmp, libblis4-pthread, libblis4-serial, libopenblas0-openmp, libopenblas0-pthread, libopenblas0-serial

• dep: libc6 (>= 2.11) [hppa]

  GNU C Library: Shared libraries
  also a virtual package provided by libc6-udeb

  dep: libc6 (>= 2.14) [amd64]

  dep: libc6 (>= 2.16) [x32]

  dep: libc6 (>= 2.17) [arm64, ppc64el]

  dep: libc6 (>= 2.27) [riscv64, sh4]

  dep: libc6 (>= 2.7) [armel, armhf, i386, m68k, mips64el, ppc64, s390x, sparc64]

• dep: libc6.1 (>= 2.27) [ia64]

  GNU C Library: Shared libraries
  also a virtual package provided by libc6.1-udeb

  dep: libc6.1 (>= 2.7) [alpha]

• dep: libfftw3-double3 (>= 3.3.5)

  Library for computing Fast Fourier Transforms - Double precision

• dep: libgcc1 (>= 1:4.0) [not arm64, hppa, i386, ia64, m68k, mips64el, riscv64, sh4]

  Package not available

  dep: libgcc1 (>= 1:4.2) [arm64, i386, ia64, mips64el, riscv64, sh4]

• dep: libgcc2 (>= 4.2.1) [m68k]

  Package not available

• dep: libgcc4 (>= 4.1.1) [hppa]

  Package not available

• dep: libgfortran5 (>= 8)

  Runtime library for GNU Fortran applications

• dep: libgomp1 (>= 4.9)

  GCC OpenMP (GOMP) support library

• dep: liblapack3

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  or liblapack.so.3

  virtual package provided by libatlas3-base, liblapack3, libopenblas0-openmp, libopenblas0-pthread, libopenblas0-serial

• dep: libmpich12 [m68k, sh4]

  Shared libraries for MPICH

• dep: libopenmpi3 [not m68k, sh4]

  high performance message passing library -- shared library

• dep: libquadmath0 (>= 4.6) [amd64, i386, ia64, ppc64el, x32]

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• dep: libunwind8 [ia64]

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• rec: openmx-data

  package for nano-scale material simulations (data)

Download openmx

Download for all available architectures

Architecture	Package Size	Installed Size	Files
alpha (unofficial port)	1,373.7 kB	4,790.0 kB	[list of files]
amd64	1,339.6 kB	4,383.0 kB	[list of files]
arm64	1,202.4 kB	3,991.0 kB	[list of files]
armel	1,299.0 kB	4,731.0 kB	[list of files]
armhf	1,234.3 kB	3,419.0 kB	[list of files]
hppa (unofficial port)	1,263.4 kB	4,136.0 kB	[list of files]
i386	1,329.1 kB	4,803.0 kB	[list of files]
ia64 (unofficial port)	1,734.2 kB	8,199.0 kB	[list of files]
m68k (unofficial port)	1,164.8 kB	4,235.0 kB	[list of files]
mips64el	1,203.8 kB	4,508.0 kB	[list of files]
ppc64 (unofficial port)	1,309.7 kB	4,692.0 kB	[list of files]
ppc64el	1,329.9 kB	4,564.0 kB	[list of files]
riscv64 (unofficial port)	1,318.8 kB	3,604.0 kB	[list of files]
s390x	1,272.3 kB	4,699.0 kB	[list of files]
sh4 (unofficial port)	1,714.5 kB	4,275.0 kB	[list of files]
sparc64 (unofficial port)	1,253.1 kB	4,450.0 kB	[list of files]
x32 (unofficial port)	1,318.9 kB	4,219.0 kB	[list of files]