mpqc3 binary package in Ubuntu Xenial ppc64el

 MPQC3 is an ab-inito quantum chemistry program. It is especially designed to
 compute molecules in an explicitly-correlated fashion.
 .
 It can compute energies and gradients for the following methods:
  * Hartree-Fock (HF)
  * Density Functional Theory (DFT)
  * Second-order Moeller-Plesset pertubation theory (MP2)
 .
 Additionally, it can compute energies for the following methods:
  * Local MP2 (LMP2)
  * Explicitly-correlated density-fitted MP2 (DF-MP2-F12)
  * Explicitly-correlated density-fitted coupled-cluster singles doubles
    (DF-CCSD-F12)
  * Explicitly-correlated density-fitted coupled-cluster singles doubles with
    perturbative triples (DF-CCSD(T)-F12)
 .
 It also includes an internal coordinate geometry optimizer.

Source package