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Number of items: 11.

Balasubramanian, Ganesh and Schulte, Joachim and Mueller-Plathe, Florian and Boehm, Michael C. (2012):
Structural and thermochemical properties of a photoresponsive spiropyran and merocyanine pair: Basis set and solvent dependence in density functional predictions.
554, In: Chemical Physics Letters, pp. 60-66, [Article]

Alaghemandi, Mohammad and Schulte, Joachim and Leroy, Frederic and Mueller-Plathe, Florian and Boehm, Michael C. (2011):
Correlation between Thermal Conductivity and Bond Length Alternation in Carbon Nanotubes: A Combined Reverse Nonequilibrium Molecular Dynamics-Crystal Orbital Analysis.
32, In: Journal of Computational Chemistry, pp. 121-133, [Article]

Böhm, Michael C. and Ramirez, Rafael and Schulte, Joachim (2007):
On the influence of vibrational modes and intramolecular isomerization processes on the NMR parameters of bullvalene : A Feynman path integral - ab initio investigation.
342, In: Chemical Physics, pp. 1-15, [Article]

Schulte, Joachim and Ramirez, Rafael and Böhm, Michael C. (2006):
Influence of nuclear fluctuations on the NMR parameters of bullvalene : A Feynman path integral - Ab initio study.
432, In: Chemical Physics Letters, pp. 579-584, [Article]

Böhm, Michael C. and Schulte, Joachim and Ramírez, Rafael (2002):
Excited state properties of C 6 H 6 and C 6 D 6 studied by Feynman path integral - ab initio simulations.
106, In: Journal of physical chemistry A, pp. 3169-3180, [Article]

Ramírez, Rafael and Böhm, Michael C. and Schulte, Joachim (2002):
Feynman path integral - ab initio investigation of the excited-state properties of benzene.
35, In: Journal of physics B: atomic, molecular and optical physics, pp. 2583-2592, [Article]

Böhm, Michael C. and Schulte, Joachim and Ramírez, Rafael (2002):
On the influence of nuclear fluctuations and calculated NMR shieldings of benzene and ethylene : a Feynman path integral - ab initio investigation.
86, In: International journal of quantum chemistry, pp. 280-296, [Article]

Schulte, Joachim and Böhm, and Dinse, (1998):
Electronic structure of endohedral SC@C82; an ab initio Hartree-Fock analysis.
In: Journal of molecular structure. 427 (1998), S. 279-292, [Article]

Schulte, Joachim and Böhm, and Dinse, (1997):
Electronic structure of Sc@C82.
In: Molecular nanostructures: Proceedings of the International Winterschool on Electronic Properties of Novel Materials. Kirchberg 1997. Hrsg.: H. Kuzmany (u.a.) - Singapore: World Scientific Publ. Comp., 1997. S. 189-192, [Conference or Workshop Item]

Schulte, Joachim (1996):
Elektronische Eigenschaften ungewöhnlicher Festkörper.
Darmstadt: 1996. 199 Bl.,
Darmstadt, Technische Univ. Darmstadt, TU Darmstadt, [Ph.D. Thesis]

Schulte, Joachim (1996):
Electronic structure of endohedral Y@C82; an ab initio Hartree-Fock investigation.
In: Chemical physics letters. 259 (1996), S. 48-54, [Article]

This list was generated on Sat Dec 7 00:17:19 2019 CET.