Publikationen von Walter Thiel

Buchkapitel (29)

2002
Buchkapitel
Thiel, W.: Untersuchungen zur übergangskatalysierten Olefinpolymerisation und zur Modellierung enzymatischer Reaktionen. In: Jahrbuch der Max-Planck-Gesellschaft, S. 509 - 516. Vandenhoeck & Ruprecht, Göttingen (2002)
2001
Buchkapitel
Döhring, A.; Jensen, V. R.; Jolly, P. W.; Thiel, W.; Weber, J. C.: Phosphino-Substituted Cyclopentadienyl Chromium Catalysts for the Oligomerization of Ethylene. In: Organometallic Catalysts and Olefin Polymerization: Catalysts for a New Millennium, S. 127 - 136 (Hg. Blom, R.; Follestad, A.; Rytter, E.). Springer, Berlin (2001)
Buchkapitel
Thiel, W.: Semiempirical Thermochemistry: A Brief Survey. In: Quantum-Mechanical Prediction of Thermochemical Data, S. 235 - 245 (Hg. Cioslowski, J.). Kluwer Academic, Dordrecht (2001)
2000
Buchkapitel
Thiel, W.: Semiempirical methods. In: Modern Methods and Algorithms of Quantum Chemistry (Hg. Grotendorst, J.). John von Neumann Institute for Computing, Jülich (2000)
1998
Buchkapitel
Antes, I.; Thiel, W.: On the Treatment of Link Atoms in Hybrid Methods. In: ACS Symposium Series, Vol. 712: Combined Quantum Mechanical and Molecular Mechanical Methods, Bd. 712, S. 50 - 65 (Hg. Gao, J.; Thompson, M. A.). American Chemical Society., Washington, DC (1998)
Buchkapitel
Thiel, W.: MNDO/d. In: Encyclopedia of Computational Chemistry, S. 1604 - 1605 (Hg. Schleyer, P. v. R.). Wiley, Chichester (1998)
Buchkapitel
Thiel, W.: MNDO. In: Encyclopedia of Computational Chemistry, S. 1599 - 1604 (Hg. Schleyer, P. v. R.). Wiley, Chichester (1998)
Buchkapitel
Thiel, W.: Thermochemistry from Semiempirical Molecular Orbital Theory. In: ACS Symposium Series, Vol. 677: Computational Thermochemistry: Prediction and Estimation of Molecular Thermodynamics, Bd. 677, S. 142 - 161 (Hg. Irikura, K. K.; Frurip, D. J.). American Chemical Society., Washington, DC (1998)
1997
Buchkapitel
Boudon, C.; Gisselbrecht, J. P.; Gross, M.; Cardullo, F.; Seiler, P.; Isaacs, L.; Nierengarten, J. F.; Haldimann, R.; Diederich, F.; Mordasini-Denti, T. et al.; Thiel, W.: REDOX BEHAVIOUR OF MONO- THROUGH HEXAKIS-ADDUCTS OF C60 FULLERENE. In: Fullerenes: Recent Advances in the Physics and Chemistry of Fullerenes and Related Materials, Vol. 5, Bd. 5, S. 95 - 98 (Hg. Ruoff, R. S.; Kadish, K. M.). The Electrochemical Society, Pennington, NJ (1997)
Buchkapitel
Bürger, H.; Thiel, W.: VIBRATION-ROTATION SPECTRA OF REACTIVE MOLECULES: INTERPLAY OF AB INITIO CALCULATIONS AND HIGH-RESOLUTION EXPERIMENTAL STUDIES. In: Vibration-Rotational Spectroscopy and Molecular Dynamics, S. 56 - 115 (Hg. Papoušek, D.). World Scientific, Singapore (1997)
Buchkapitel
Patchkovskii, S.; Thiel, W.: THEORETICAL STUDY OF HELIUM INCORPORATION BY BUCKMINSTERFULLERENE. In: Fullerenes: Recent Advances in the Physics and Chemistry of Fullerenes and Related Materials, Vol. 5, Bd. 5, S. 126 - 137 (Hg. Ruoff, R. S.; Kadish, K. M.). The Electrochemical Society, Pennington, NJ (1997)
1996
Buchkapitel
Bakowies, D.; Bühl, M.; Patchkovskii, S.; Thiel, W.: Theoretical Studies on Giant Fullerenes and on Endohedral Fullerene Complexes. In: Proceedings of the Symposium on Recent Advances in the Chemistry and Physics of Fullerenes and Related Materials, Vol. 3, Bd. 3 (Hg. Kadish, K. M.; Ruoff, R. S.). The Electrochemical Society, Inc., Pennington, NJ (1996)
Buchkapitel
Thiel, W.: Perspectives on Semiempirical Molecular Orbital Theory. In: Advances in Chemical Physics, Vol. 93, Bd. 93, S. 703 - 757 (Hg. Prigogine, I.; Rice, S. A.). John Wiley & Sons, Inc., New York (1996)
1995
Buchkapitel
Green, D. G.; Boston, I. E.; Thiel, W.: Parallelization in quantum chemistry: The MNDO code. In: Lecture Notes in Computer Science, Vol. 919, Bd. 919, S. 880 - 995 (Hg. Hertzberger, B.; Serazzi, G.). Springer, Berlin (1995)
Buchkapitel
Thiel, W.; Green, D. G.: The MNDO94 Code: Parallelization of a Semiempirical Quantum-chemical Program. In: Methods and Techniques in Computational Chemistry METECC-95, S. 880 - 885 (Hg. Clementi, E.; Corongiu, G.). STEF, Cagliari (1995)
1994
Buchkapitel
Vasella, A.; Ermert, P.; Hoos, R.; Naughton, A. B.; Rupitz, K.; Thiel, W.; Weber, M.; Weber, W.; Withers, S. G.: Synthesis and evaluation of new glycosidase inhibitors. In: COMPLEX CARBOHYDRATES IN DRUG RESEARCH, S. 135 - 150 (Hg. Bock, K.; Clausen, H.). Munksgaard, Copenhagen (1994)

Konferenzband (1)

2012
Konferenzband
Rotation-vibration energy level cluster formation in three- and four-atomic molecules (AIP Conference Proceedings, 1504 ). International Conference of Computational Methods in Sciences and Engineering 2009: (iccmse 2009), Rhodes, Greece, 29. September 2009 - 04. Oktober 2009. AIP Journals, Rhodes (2012), 500 S.
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