OCC

Performs orbital-optimized MPn and CC computations and conventional MPn computations.

  • CURRENT CORRELATION ENERGY
  • CURRENT ENERGY
  • CURRENT REFERENCE ENERGY
  • LCCD CORRELATION ENERGY
  • LCCD TOTAL ENERGY
  • MP2 CORRELATION ENERGY
  • MP2 OPPOSITE-SPIN CORRELATION ENERGY
  • MP2 SAME-SPIN CORRELATION ENERGY
  • MP2 TOTAL ENERGY
  • MP2.5 CORRELATION ENERGY
  • MP2.5 TOTAL ENERGY
  • MP3 CORRELATION ENERGY
  • MP3 TOTAL ENERGY
  • OLCCD CORRELATION ENERGY
  • OLCCD TOTAL ENERGY
  • OMP2 TOTAL ENERGY
  • OMP2.5 CORRELATION ENERGY
  • OMP2.5 TOTAL ENERGY
  • OMP3 CORRELATION ENERGY
  • OMP3 TOTAL ENERGY
  • SCS-MP2 CORRELATION ENERGY
  • SCS-MP2 TOTAL ENERGY
  • SCS-MP2-VDW CORRELATION ENERGY
  • SCS-MP2-VDW TOTAL ENERGY
  • SCS-MP3 CORRELATION ENERGY
  • SCS-MP3 TOTAL ENERGY
  • SCS-MP3-VDW CORRELATION ENERGY
  • SCS-MP3-VDW TOTAL ENERGY
  • SCS-OLCCD CORRELATION ENERGY
  • SCS-OLCCD TOTAL ENERGY
  • SCS-OMP2 CORRELATION ENERGY
  • SCS-OMP2 TOTAL ENERGY
  • SCS-OMP2-VDW CORRELATION ENERGY
  • SCS-OMP2-VDW TOTAL ENERGY
  • SCS-OMP3 CORRELATION ENERGY
  • SCS-OMP3 TOTAL ENERGY
  • SCS-OMP3-VDW CORRELATION ENERGY
  • SCS-OMP3-VDW TOTAL ENERGY
  • SCSN-MP2 CORRELATION ENERGY
  • SCSN-MP2 TOTAL ENERGY
  • SCSN-MP3 CORRELATION ENERGY
  • SCSN-MP3 TOTAL ENERGY
  • SCSN-OMP2 CORRELATION ENERGY
  • SCSN-OMP2 TOTAL ENERGY
  • SCSN-OMP3 CORRELATION ENERGY
  • SCSN-OMP3 TOTAL ENERGY
  • SOS-MP2 CORRELATION ENERGY
  • SOS-MP2 TOTAL ENERGY
  • SOS-MP3 CORRELATION ENERGY
  • SOS-MP3 TOTAL ENERGY
  • SOS-OLCCD CORRELATION ENERGY
  • SOS-OLCCD TOTAL ENERGY
  • SOS-OMP2 CORRELATION ENERGY
  • SOS-OMP2 TOTAL ENERGY
  • SOS-OMP3 CORRELATION ENERGY
  • SOS-OMP3 TOTAL ENERGY
  • SOS-PI-MP2 CORRELATION ENERGY
  • SOS-PI-MP2 TOTAL ENERGY
  • SOS-PI-MP3 CORRELATION ENERGY
  • SOS-PI-MP3 TOTAL ENERGY
  • SOS-PI-OMP2 CORRELATION ENERGY
  • SOS-PI-OMP2 TOTAL ENERGY
  • SOS-PI-OMP3 CORRELATION ENERGY
  • SOS-PI-OMP3 TOTAL ENERGY