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26. Die automatische Planung und Auswertung von Versuchen zur Entwicklung mechanistischer Modelle chemischer Reaktionen

Miller, Oscar Paul (1976)


Doctoral and Habilitation Theses

27. Dissecting the quantum chemical spin state problem

Boguslawski, Katharina (2012)


Doctoral and Habilitation Theses

28. Einfluss des Kristallfeldes auf magnetische Eigenschaften und Dynamik von Sandwichkomplexen

Wolf, Robert (1982)


Doctoral and Habilitation Theses

29. Ein Modell zur Beschreibung von Komplexen einiger Kationen mit neutralen Liganden

Badertscher, Martin (1988)


Doctoral and Habilitation Theses

30. Einsatz von genetischen Algorithmen in molecular modeling

Brodmeier, Tilman Klaus Dieter (1996)


Doctoral and Habilitation Theses

31. Electron delocalization in through and cross conjugated oligomers and its influence on the molecular properties

Limacher, Peter Andreas (2010)


Doctoral and Habilitation Theses

32. Electron density in quantum chemistry

Fux, Samuel (2011)


Doctoral and Habilitation Theses

33. Electrostatic interactions in computer simulations of (bio-)molecular systems

Kastenholz, Mika Arnold (2006)


Doctoral and Habilitation Theses

34. Enhanced conformational sampling in molecular dynamics simulations

Schrøder Hansen, Halvor (2010)


Doctoral and Habilitation Theses

35. Entwicklung einer Hypermedia-Applikation für die Interpretation von Molekülspektren

Cadisch, Marc Reto (1992)


Doctoral and Habilitation Theses

36. Exact decoupling of the relativistic Fock operator

Peng, Daoling and Reiher, Markus (2012)


Journal Items

37. Greenfunktionen und Quasiteilchen in der Quantenchemie

Münch, Walter Friedrich (1971)


Doctoral and Habilitation Theses

38. Heteroatom stabilized group 14 cations

Marchand, Christina M. (1997)


Doctoral and Habilitation Theses

39. Implementation and application of a new approach for extending time scales in ab-initio molecular dynamics simulations

Aktah, Daniel (2003)


Doctoral and Habilitation Theses

40. Invariant manifolds and lattice Boltzmann method for combustion

Chiavazzo, Eliodoro (2009)


Doctoral and Habilitation Theses

41. Ion binding models for natural heterogeneous materials

Rusch, Ursula (1998)


Doctoral and Habilitation Theses

42. Large scale motions in macromolecules

Petraglio, Gabriele Carlo Luigi (2006)


Doctoral and Habilitation Theses

43. Laser ablation ICP-MS

Kuhn, Hans-Rudolf (2005)


Doctoral and Habilitation Theses

44. Linking structure and function at the surface of selected metal-based solids through atomistic simulations

Gaspari, Roberto (2012)


Doctoral and Habilitation Theses

45. Mechanistic studies of organometallic complexes

Narancic, Sanja (2007)


Doctoral and Habilitation Theses

46. Methodological advances in relativistic quantum chemistry

Mastalerz, Remigius Paul (2009)


Doctoral and Habilitation Theses

47. Methodological advances in theoretical spectroscopy for bio and inorganic molecules

Luber, Sandra Erika (2009)


Doctoral and Habilitation Theses

48. Modifikation der "Extended Hückel" Theorie

Baumann, Harold Frank (1968)


Doctoral and Habilitation Theses

49. Molecular dynamics simulation based on quantum and classical statistical mechanics: methodological investigations, implementation, and perspectives

Meier, Katharina (2012)


Doctoral and Habilitation Theses

50. Molecular dynamics simulations using empirical force fields

Hünenberger, Philippe Henry (1997)


Doctoral and Habilitation Theses