mpqc binary package in Ubuntu Xenial armhf

 MPQC is an ab-inito quantum chemistry program. It is especially designed
 to compute molecules in a highly parallelized fashion.
 .
 It can compute energies and gradients for the following methods:
  * Closed shell and general restricted open shell Hartree-Fock (HF)
  * Density Functional Theory (DFT)
  * Closed shell second-order Moeller-Plesset pertubation theory (MP2)
 .
 Additionally, it can compute energies for the following methods:
  * Open shell MP2 and closed shell explicitly correlated MP2 theory (MP2-R12)
  * Second order open shell pertubation theory (OPT2[2])
  * Z-averaged pertubation theory (ZAPT2)
 .
 It also includes an internal coordinate geometry optimizer.
 .
 MPQC is built upon the Scientific Computing Toolkit (SC).

Publishing history

Date Status Target Pocket Component Section Priority Phased updates Version
  2016-02-15 17:09:01 UTC Published Ubuntu Xenial armhf release universe science Optional 2.3.1-16ubuntu5
  • Published
  • Copied from ubuntu xenial-proposed armhf in Primary Archive for Ubuntu
  Deleted Ubuntu Xenial armhf proposed universe science Optional 2.3.1-16ubuntu5
  • Removal requested .
  • Deleted by Ubuntu Archive Robot

    moved to release

  • Published
  2016-02-06 21:37:01 UTC Superseded Ubuntu Xenial armhf proposed universe science Optional 2.3.1-16ubuntu4
  • Removed from disk .
  • Removal requested .
  • Superseded by armhf build of mpqc 2.3.1-16ubuntu5 in ubuntu xenial PROPOSED
  • Published
  2016-02-15 17:24:27 UTC Superseded Ubuntu Xenial armhf release universe science Optional 2.3.1-16ubuntu3
  • Removed from disk .
  • Removal requested .
  • Superseded by armhf build of mpqc 2.3.1-16ubuntu5 in ubuntu xenial PROPOSED
  • Published
  • Copied from ubuntu wily-proposed armhf in Primary Archive for Ubuntu

Source package