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Calculation Of Static Polarizabilities

input and output for the calculation of static polarizabilities at RHF-SCF level
input and output for the calculation of static polarizabilities at RHF-MP2 level
input and output for the calculation of static polarizabilities at RHF-CCSD(T) level
input and output for the calculation of static polarizabilities at RHF-CCSDT level

input and output for the calculation of static polarizabilities at UHF-SCF level
input and output for the calculation of static polarizabilities at UHF-CCSD level

input and output for the calculation of static polarizabilities at RHF-CCSD level without consideration of orbital relaxation

input and output for the calculation of static polarizabilities at RHF-CCSD(T) level using the CC module xecc and AO-based algorithm (intended for large-scale calculation)

input and output for the calculation of static polarizabilities at RHF-CCSD(T) level with frozen-core orbitals

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Page last modified on November 29, 2010, at 04:24 PM
This page has been visited 94 times since December 2010.
CFOUR is partially supported by the U.S. National Science Foundation.