The PRTRAN program


The module PRTRAN can compute expectation values for various properties. Also, our coupled-cluster code relccsd.x can perform linear response calculations using RPA. However, we do NOT have a general integral code to compute the various property integrals. In order to compute various properties one needs to have access to the DIRAC code of the Quantum Chemistry Group of the university of Olso. At present the DIRAC code is maintained in Denmark: http://dirac.chem.sdu.dk


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