mpqc-data-2.3.1-17-omv2015.0.i586.rpm


Advertisement

Description

mpqc-data - Atom info and basis sets from MPQC

Distribution: OpenMandriva Lx 3.0
Repository: OpenMandriva Contrib i586
Package name: mpqc-data
Package version: 2.3.1
Package release: 17-omv2015.0
Package architecture: i586
Package type: rpm
Installed size: 1.85 MB
Download size: 139.62 KB
Official Mirror: abf-downloads.openmandriva.org
Atom info and basis sets from MPQC.

Alternatives

Requires

Provides

  • mpqc-data == 2.3.1-17:2015.0
  • perl(AtomicBases)
  • perl(AtomicBasis)
  • perl(InputWriter)
  • perl(MPQCInputWriter)
  • perl(Molecule)
  • perl(QCInput)
  • perl(QCParse)
  • perl(QCResult)

    Download

    Install Howto

    1. Enable OpenMandriva Contrib repository on Install and Remove Software"
    2. Update packages list:
      # urpmi.update -a
    3. Install mpqc-data rpm package:
      # urpmi mpqc-data

    Files

    • /usr/share/mpqc/
    • /usr/share/mpqc/2.3.1/atominfo.kv
    • /usr/share/mpqc/2.3.1/ccarunproc
    • /usr/share/mpqc/2.3.1/magic
    • /usr/share/mpqc/2.3.1/mpqcrunproc
    • /usr/share/mpqc/2.3.1/basis/3-21PPg.kv
    • /usr/share/mpqc/2.3.1/basis/3-21PPgS.kv
    • /usr/share/mpqc/2.3.1/basis/3-21g.kv
    • /usr/share/mpqc/2.3.1/basis/3-21gS.kv
    • /usr/share/mpqc/2.3.1/basis/4-31g.kv
    • /usr/share/mpqc/2.3.1/basis/6-311PPgL2d_2pR.kv
    • /usr/share/mpqc/2.3.1/basis/6-311PPgL3df_3pdR.kv
    • /usr/share/mpqc/2.3.1/basis/6-311PPgSS.kv
    • /usr/share/mpqc/2.3.1/basis/6-311g.kv
    • /usr/share/mpqc/2.3.1/basis/6-311gL2df_2pdR.kv
    • /usr/share/mpqc/2.3.1/basis/6-311gS.kv
    • /usr/share/mpqc/2.3.1/basis/6-311gSS.kv
    • /usr/share/mpqc/2.3.1/basis/6-31PPg.kv
    • /usr/share/mpqc/2.3.1/basis/6-31PPgS.kv
    • /usr/share/mpqc/2.3.1/basis/6-31PPgSS.kv
    • /usr/share/mpqc/2.3.1/basis/6-31PgS.kv
    • /usr/share/mpqc/2.3.1/basis/6-31g.kv
    • /usr/share/mpqc/2.3.1/basis/6-31gS.kv
    • /usr/share/mpqc/2.3.1/basis/6-31gSS.kv
    • /usr/share/mpqc/2.3.1/basis/aug-cc-pcv5z.kv
    • /usr/share/mpqc/2.3.1/basis/aug-cc-pcvdz.kv
    • /usr/share/mpqc/2.3.1/basis/aug-cc-pcvqz.kv
    • /usr/share/mpqc/2.3.1/basis/aug-cc-pcvtz.kv
    • /usr/share/mpqc/2.3.1/basis/aug-cc-pv5z.kv
    • /usr/share/mpqc/2.3.1/basis/aug-cc-pv6z.kv
    • /usr/share/mpqc/2.3.1/basis/aug-cc-pvdz.kv
    • /usr/share/mpqc/2.3.1/basis/aug-cc-pvqz.kv
    • /usr/share/mpqc/2.3.1/basis/aug-cc-pvtz.kv
    • /usr/share/mpqc/2.3.1/basis/cc-pcv5z.kv
    • /usr/share/mpqc/2.3.1/basis/cc-pcvdz.kv
    • /usr/share/mpqc/2.3.1/basis/cc-pcvqz.kv
    • /usr/share/mpqc/2.3.1/basis/cc-pcvtz.kv
    • /usr/share/mpqc/2.3.1/basis/cc-pv5z.kv
    • /usr/share/mpqc/2.3.1/basis/cc-pv6z.kv
    • /usr/share/mpqc/2.3.1/basis/cc-pvdz.kv
    • /usr/share/mpqc/2.3.1/basis/cc-pvqz.kv
    • /usr/share/mpqc/2.3.1/basis/cc-pvtz.kv
    • /usr/share/mpqc/2.3.1/basis/dz_LdunningR.kv
    • /usr/share/mpqc/2.3.1/basis/dzp_LdunningR.kv
    • /usr/share/mpqc/2.3.1/basis/dzp_P_diffuse_LdunningR.kv
    • /usr/share/mpqc/2.3.1/basis/midi_LhuzinagaR.kv
    • /usr/share/mpqc/2.3.1/basis/mini_LhuzinagaR.kv
    • /usr/share/mpqc/2.3.1/basis/mini_LscaledR.kv
    • /usr/share/mpqc/2.3.1/basis/nasa_ames_ano.kv
    • /usr/share/mpqc/2.3.1/basis/pc-0-aug.kv
    • /usr/share/mpqc/2.3.1/basis/pc-0.kv
    • /usr/share/mpqc/2.3.1/basis/pc-1-aug.kv
    • /usr/share/mpqc/2.3.1/basis/pc-1.kv
    • /usr/share/mpqc/2.3.1/basis/pc-2-aug.kv
    • /usr/share/mpqc/2.3.1/basis/pc-2.kv
    • /usr/share/mpqc/2.3.1/basis/pc-3-aug.kv
    • /usr/share/mpqc/2.3.1/basis/pc-3.kv
    • /usr/share/mpqc/2.3.1/basis/pc-4-aug.kv
    • /usr/share/mpqc/2.3.1/basis/pc-4.kv
    • /usr/share/mpqc/2.3.1/basis/sto-2g.kv
    • /usr/share/mpqc/2.3.1/basis/sto-3g.kv
    • /usr/share/mpqc/2.3.1/basis/sto-3gS.kv
    • /usr/share/mpqc/2.3.1/basis/sto-6g.kv
    • /usr/share/mpqc/2.3.1/basis/tz_LdunningR.kv
    • /usr/share/mpqc/2.3.1/elisp/SC.el
    • /usr/share/mpqc/2.3.1/elisp/compile.el
    • /usr/share/mpqc/2.3.1/elisp/keyval.el
    • /usr/share/mpqc/2.3.1/elisp/mpqc.el
    • /usr/share/mpqc/2.3.1/perl/AtomicBases.pm
    • /usr/share/mpqc/2.3.1/perl/AtomicBasis.pm
    • /usr/share/mpqc/2.3.1/perl/Molecule.pm
    • /usr/share/mpqc/2.3.1/perl/QCParse.pm
    • /usr/share/mpqc/2.3.1/perl/QCResult.pm
    Advertisement
    Advertisement