input and
output for HF-SCF calculation
input and
output for MP2/MBPT(2) calculation
input and
output for CCSD calculation
input and
output for CCSD(T) calculation
input and
output for CC3 calculation
input and
output for CCSDT calculation
input and
output for CCSD calculation using partial AO algorithms.
input an
output for CCSD(T) calculation using partial AO algorithm
input and
output for CCSD(T) calculation using xecc
input and
output for CCSD(T) calculation using xecc together with partial AO algorithm
input and
output for CCSDT calculation using xecc
input and
output for CCSD(T) calculation with frozen-core orbitals