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383. MOPN: Unrestricted Hartree-Fock Version of
MINDO/3
by P. Bischof, Institut fr Organische Chemie der Technischen Hochschule Darmstadt, Darmstadt, West Germany This program was developed from MINDO/3. Whereas in MINDO/3 it was necessary to use a "half electron" technique to deal with open-shell species, it is no longer required in this system. As the system is being delivered by QCPE, it is set up to handle 30 atoms and 100 orbitals. The program contains COMMENT cards which give directions for redimensioning the system. FORTRAN IV (IBM) Lines of Code: 3215 Recommended Citation: P. Bischof, QCPE 11, 383 (1979). |