apl. Prof. Dr. Timothy Clark

Naturwissenschaftliche Fakultät Computer-Chemie-Centrum (CCC)

The photodegradation of poly(2,6-dimethyl-1,4-phenylene oxide) - Experimental and theoretical studies on model compounds (1996) Schneider S, Gedeck P, Clark T Journal article Investigation of the uncatalyzed hydration of CO2 and first approximations to the active site of carbonic anhydrase - A combined Ab initio and DFT study (1996) Hartmann M, Clark T, van Eldik R Journal article Ab initio calculations on electron-transfer catalysis by metal ions (1996) Clark T Authored book Theoretical study of the water exchange reaction on divalent zinc ion using density functional theory (1996) Hartmann M, Clark T, van Eldik R Journal article AM1 AND PM3 CALCULATIONS ON THE EFFECT OF SUBSTITUENTS ON THE STABILITIES OF CARBOCATIONS IN THE GAS-PHASE AND IN SOLUTION (1995) Clark T Journal article POLARON MIGRATION IN DOPED POLYSILANES - AM1 CALCULATIONS ON THE RADICAL-CATION SI-17(CH3)(36)(+) (1995) Clark T Journal article IMPROVING NUMERICAL SCRF TECHNIQUES FOR GROUND AND EXCITED-STATES (1995) Clark T Journal article INVESTIGATION OF ORGANOLITHIUM DIMERIZATION ON IRRADIATED CDS POWDER (1995) Clark T Journal article A combined semiempirical MO neural net technique for estimating C-13 chemical shifts (1995) Clark T, Rauhut G, Breindl A Journal article A detailed study of VESPA electrostatic potential-derived atomic charges (1995) Beck B, Clark T, Glen R Journal article