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Computer-Chemie-Centrum (CCC)
Friedrich-Alexander-Universität Erlangen-Nürnberg
Naturwissenschaftliche Fakultät
Department Chemie und Pharmazie
Overview
Publications
(671)
Research Grants
(6)
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THE NATURAL ATOMIC ORBITAL POINT-CHARGE MODEL FOR PM3 - MULTIPOLE MOMENTS AND MOLECULAR ELECTROSTATIC POTENTIALS (1994)
Beck B, Rauhut G, Clark T
Journal article
A SYMPOSIUM ON POTENTIAL-ENERGY SURFACES AND ORGANIC-REACTION PATHS WAS HELD AT THE UNIVERSITY-OF-OXFORD ON THE 15TH, 16TH AND 17TH DECEMBER 1993 - GENERAL DISCUSSION (1994)
Clark T, Schleyer P
Journal article
MOLECULAR-ORBITAL STUDIES OF ELECTRON-TRANSFER REACTIONS (1994)
Rauhut G, Clark T
Journal article
MECHANISMS OF AROMATIC LITHIATION INFLUENCE OF AGGREGATION AND DIRECTING GROUPS (1994)
van Eikema Hommes N, Schleyer P
Journal article
NUCLEOPHILIC RING-OPENING OF EPOXIDES BY ORGANOLITHIUM COMPOUNDS - AB-INITIO MECHANISMS (1994)
Harder S, van Lenthe J, van Eikema Hommes N, Schleyer P
Journal article
LASER-INDUCED CROSS-LINKING OF SILOXANES - A SEMIEMPIRICAL MOLECULAR-ORBITAL STUDY (1994)
Clark T
Journal article
INVERSELY COORDINATING SILANIDE IONS IN AN OLIGOMERIC SODIUM ALCOHOLATE (1994)
Pritzkow H, Lobreyer T, Sundermeyer W, van Eikema Hommes N, Schleyer P
Journal article
ETA(3) AND ETA(6) BRIDGING CATIONS IN THE N,N,N',N'',N''-PENTAMETHYLDIETHYLENETRIAMINE-SOLVATED COMPLEXES OF BENZYLPOTASSIUM AND BENZYLRUBIDIUM - AN X-RAY, NMR, AND MO STUDY (1994)
Hoffmann D, Bauer W, Hampel F, van Eikema Hommes N, Schleyer P, Otto P, Pieper U, et al.
Journal article
A NUMERICAL SELF-CONSISTENT REACTION FIELD (SCRF) MODEL FOR GROUND AND EXCITED-STATES IN NDDO-BASED METHODS (1993)
Rauhut G, Clark T
Journal article
ELECTRON-TRANSFER REACTIONS - AM1 AND AB-INITIO STUDIES ON SELF-EXCHANGE IN P-DIAMINOBENZENE SYSTEMS (1993)
Rauhut G, Clark T
Journal article
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