nwchem_6.0-1_amd64.deb


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Description

nwchem - High-performance computational chemistry software

Property Value
Distribution Ubuntu 12.04 LTS (Precise Pangolin)
Repository Ubuntu Universe amd64
Package name nwchem
Package version 6.0
Package release 1
Package architecture amd64
Package type deb
Installed size 51.75 KB
Download size 11.96 MB
Official Mirror archive.ubuntu.com
NWChem aims to provide its users with computational chemistry tools that are
scalable both in their ability to treat large scientific computational
chemistry problems efficiently, and in their use of available parallel
computing resources from high-performance parallel supercomputers to
conventional workstation clusters.  NWChem software can handle
* Biomolecules, nanostructures, and solid-state
* From quantum to classical, and all combinations
* Gaussian basis functions or plane-waves
* Scaling from one to thousands of processors
* Properties and relativity

Alternatives

Package Version Architecture Repository
nwchem_6.0-1_i386.deb 6.0 i386 Ubuntu Universe
nwchem - - -

Requires

Name Value
libc6 >= 2.11
libgfortran3 >= 4.6
nwchem-data = 6.0-1

Download

Type URL
Binary Package nwchem_6.0-1_amd64.deb
Source Package nwchem

Install Howto

  1. Update the package index:
    # sudo apt-get update
  2. Install nwchem deb package:
    # sudo apt-get install nwchem

Files

Path
/usr/bin/nwchem
/usr/share/doc/nwchem/changelog.Debian.gz
/usr/share/doc/nwchem/copyright
/usr/share/doc/nwchem/progpdf.pdf.gz
/usr/share/doc/nwchem/userpdf.pdf.gz
/usr/share/doc/nwchem/examples/h2o-camb3lyp-pol-cdfit.nw
/usr/share/doc/nwchem/examples/h2o-camb3lyp-pol.nw
/usr/share/doc/nwchem/examples/h2o-cambeckehh.nw
/usr/share/doc/nwchem/examples/h2o-campbe0.nw
/usr/share/doc/nwchem/examples/h2o-lcpbe.nw
/usr/share/doc/nwchem/examples/h2o-noscf.nw
/usr/share/doc/nwchem/examples/h2o-response.nw
/usr/share/doc/nwchem/examples/h2o-ssb-d-opt.nw
/usr/share/doc/nwchem/examples/h2o-ssb-d.nw
/usr/share/doc/nwchem/examples/h2o.nw
/usr/share/doc/nwchem/examples/h2o_bnl.nw
/usr/share/doc/nwchem/examples/h2o_dft.nw
/usr/share/doc/nwchem/examples/h2o_dk.nw
/usr/share/doc/nwchem/examples/h2o_fixed.nw
/usr/share/doc/nwchem/examples/h2o_hcons.nw
/usr/share/doc/nwchem/examples/h2o_scf.nw
/usr/share/doc/nwchem/examples/h2o_selci.nw
/usr/share/doc/nwchem/examples/h2o_vscf.nw
/usr/share/doc/nwchem/examples/input.nw
/usr/share/nwchem/libraries/basis

See Also

Package Description
nwrite_1.9.2-20_amd64.deb Enhanced replacement for the write command
nxproxy_3.5.0-1-0ubuntu1_amd64.deb NX X compression library
nypatchy_20061220+dfsg3-2_amd64.deb CERNLIB data analysis suite - patch pre-processor for source code
nzb_0.1.9-1_amd64.deb An nzb based Usenet binary grabber
nzbget_0.7.0-2_amd64.deb command-line based binary newsgrabber for nzb files
oaklisp-doc_1.3.3-5_all.deb Documentation for the Oaklisp dialect of Scheme
oasis3-examples_3.3.beta.dfsg.1-5build1_amd64.deb Example models for the OASIS climate model coupler
oasis3_3.3.beta.dfsg.1-5build1_amd64.deb Coupler for exchanging fields between components of Earth system models
oasis_0.2.0-5build3_all.deb Architecture for building OCaml libraries and applications
oathtool_1.10.4-1_amd64.deb OATH Toolkit oathtool command line tool
obconf_2.0.3+git20110808-1_amd64.deb preferences manager for Openbox window manager
obdgpslogger_0.16-1.1ubuntu1_amd64.deb suite of tools to log OBDII and GPS data
obexd-server_0.44-0ubuntu1_amd64.deb D-Bus OBEX server
obexfs_0.11-1_amd64.deb mount filesystem of ObexFTP capable devices
obexftp_0.23-1build3_amd64.deb file transfer utility for devices that use the OBEX protocol
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