Citation: B. Kallies et R. Mitzner, MODELS OF WATER-ASSISTED HYDROLYZES OF METHYL FORMATE, FORMAMIDE, ANDUREA FROM COMBINED DFT-SCRF CALCULATIONS, JOURNAL OF MOLECULAR MODELING, 4(6), 1998, pp. 183-196
Citation: T. Beitz et al., INVESTIGATIONS OF REACTIONS OF SELECTED AZAARENES WITH RADICALS IN WATER - 1 - HYDROXYL AND SULFATE RADICALS, The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 102(34), 1998, pp. 6760-6765
Citation: T. Beitz et al., INVESTIGATIONS OF REACTIONS OF SELECTED AZAARENES WITH RADICALS IN WATER - 2 - CHLORINE AND BROMINE RADICALS, The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 102(34), 1998, pp. 6766-6771
Citation: B. Kallies et R. Mitzner, STRUCTURAL-PROPERTIES OF PROTONATED ACYL DERIVATIVES AS STUDIED BY QUANTUM-MECHANICS, Journal of molecular structure. Theochem, 428, 1998, pp. 267-282
Citation: B. Kallies et R. Mitzner, PK(A) VALUES OF AMINES IN WATER FROM QUANTUM-MECHANICAL CALCULATIONS USING A POLARIZED DIELECTRIC CONTINUUM REPRESENTATION OF THE SOLVENT, JOURNAL OF PHYSICAL CHEMISTRY B, 101(15), 1997, pp. 2959-2967
Authors:
FIRTH S
COHEUR PF
MITZNER R
CARLEER M
CAMPBELL EEB
COLIN R
KROTO HW
Citation: S. Firth et al., THE DISPERSED LASTER INDUCED FLUORESCENCE-SPECTRUM OF GAS-PHASE C-60 AT 308 NM - REPLY, Journal of physics. B, Atomic molecular and optical physics, 30(19), 1997, pp. 4417-4417
Authors:
FIRTH S
COHEUR PF
MITZNER R
CARLEER M
CAMPBELL EEB
COLIN R
KROTO HW
Citation: S. Firth et al., THE DISPERSED LASER-INDUCED FLUORESCENCE-SPECTRUM OF GAS-PHASE C-60 AT 308 NM, Journal of physics. B, Atomic molecular and optical physics, 30(11), 1997, pp. 393-400
Citation: B. Kallies et al., COMPETITIVE RESONANCE AT THE CARBONYL GROUP AS VISUALIZED BY THE NATURAL BOND ORBITAL ANALYSIS, Journal of molecular structure, 435(2), 1997, pp. 123-132
Citation: B. Kallies et R. Mitzner, SUBSTRATE-SPECIFICITY OF CHYMOTRYPSIN - STUDY OF INDUCED STRAIN BY MOLECULAR MECHANICS, JOURNAL OF MOLECULAR MODELING, 2(6), 1996, pp. 149-159
Citation: B. Kallies et R. Mitzner, STUDY OF ELECTRON-DENSITIES OF METHYL ACETATE, N-METHYLACETAMIDE AND N,N'-DIMETHYLUREA BY QUANTUM-MECHANICAL INVESTIGATIONS .1. GAS-PHASE, Perkin transactions. 2, (7), 1996, pp. 1397-1401
Citation: B. Kallies et R. Mitzner, STUDY OF ELECTRON-DENSITIES OF METHYL ACETATE, N-METHYLACETAMIDE AND N,N'-DIMETHYLUREA BY QUANTUM-MECHANICAL INVESTIGATIONS .2. SOLVENT MODELS, Perkin transactions. 2, (7), 1996, pp. 1403-1408
Authors:
MITZNER R
WINTER B
KUSCH C
CAMPBELL EEB
HERTEL IV
Citation: R. Mitzner et al., COALESCENCE REACTIONS IN LASER-INDUCED FULLERENE DESORPTION - THE ROLE OF FRAGMENTS, Zeitschrift fur Physik. D, Atoms, molecules and clusters, 37(1), 1996, pp. 89-95
Citation: B. Kallies et R. Mitzner, THE ABILITY OF THE SEMIEMPIRICAL PM3 METHOD TO MODEL PROTON-TRANSFER REACTIONS IN SYMMETRICAL HYDROGEN-BONDED SYSTEMS, JOURNAL OF MOLECULAR MODELING, 1(2), 1995, pp. 68-78
Citation: J. Bendig et R. Mitzner, LASER PHOTOLYSIS OF NAPHTHOQUINONE DIAZIDE IN CYCLOHEXANE - 2-LASER CHEMISTRY, Berichte der Bunsengesellschaft fur Physikalische Chemie, 98(8), 1994, pp. 1004-1008