Items where Division is "Chemistry and Pharmacy > Institut für Physikalische und Theoretische Chemie" and Year is 2003
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Abe, Atsutoshi and Yamashita, Koichi and Saalfrank, Peter (2003) STM and laser-driven atom switch: An open-system density-matrix study of H/Si(100). PHYSICAL REVIEW B, 67 (23): 235411. ISSN 1098-0121
Andrianov, I. and Saalfrank, P. (2003) Performance of higher order Monte Carlo wave packet methods for surface science problems: A test for photoinduced desorption. CHEMICAL PHYSICS LETTERS, 367 (3-4). pp. 455-462. ISSN 0009-2614
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Homeier, Herbert H. H. (2003) A modified Newton method for rootfinding with cubic convergence. JOURNAL OF COMPUTATIONAL AND APPLIED MATHEMATICS, 157 (1). pp. 227-230. ISSN 0377-0427
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Kartsev, V. N. and Rodnikova, M. N. and Shtykov, S. N. and Bartel, J. (2003) Internal pressure in binary aqueous solutions of monoethanolamine, diamines, and diols. RUSSIAN JOURNAL OF PHYSICAL CHEMISTRY, 77 (8). pp. 1303-1309. ISSN 0036-0244
Kottke, Tilman and Dick, Bernhard and Fedorov, Roman and Schlichting, Ilme and Deutzmann, Rainer and Hegemann, Peter (2003) Irreversible photoreduction of flavin in a mutated Phot-LOV1 domain. BIOCHEMISTRY, 42 (33). pp. 9854-9862. ISSN 0006-2960
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Moreira, André G. and Baeurle, Stephan A. and Fredrickson, Glenn H. (2003) Global stationary phase and the sign problem. PHYSICAL REVIEW LETTERS, 91 (15): 150201. ISSN 0031-9007, 1079-7114
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Neiss, Christian and Saalfrank, Peter (2003) Ab initio quantum chemical investigation of the first steps of the photocycle of phototropin: A model study. PHOTOCHEMISTRY AND PHOTOBIOLOGY, 77 (1). pp. 101-109. ISSN 0031-8655
Neiss, Christian and Saalfrank, Peter and Parac, Maja and Grimme, Stefan (2003) Quantum chemical calculation of excited states of flavin-related molecules. JOURNAL OF PHYSICAL CHEMISTRY A, 107 (1). pp. 140-147. ISSN 1089-5639
Novikov, A. G. and Rodnikova, M. N. and Bartel, J. and Sobolev, O. V. (2003) Diffusion of large single-charge ions in aqueous solutions. RUSSIAN JOURNAL OF INORGANIC CHEMISTRY, 48 (3). pp. 403-405. ISSN 0036-0236
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Weniger, E. J. and Kirtman, B. (2003) Extrapolation methods for improving the convergence of oligomer calculations to the infinite chain limit of quasi-one-dimensional stereoregular polymers. COMPUTERS & MATHEMATICS WITH APPLICATIONS, 45 (1-3). pp. 189-215. ISSN 0898-1221, 1873-7668
