Matthew D. Kundrat, PhD
Affiliations: | 1997-2000 | Chemistry | Wayne State University, Detroit, MI, United States |
2004-2008 | Chemistry | State University of New York, Buffalo, Buffalo, NY, United States | |
2012-2014 | Center for Functional Nanostructures | Karlsruher Institut für Technologie |
Area:
ChemistryWebsite:
http://mattkundrat.euGoogle:
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Parents
Sign in to add mentorDarryl S. Williams | grad student | 1997-1998 | Wayne State | |
Jochen Autschbach | grad student | 2004-2008 | SUNY Buffalo | |
(Time dependent density functional theory modeling of chiroptical properties of amino acids in solution.) | ||||
Christoph R. Jacob | post-doc | 2012-2014 | Karlsruher Institut für Technologie |
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Publications
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Boubnov A, Roppertz A, Kundrat MD, et al. (2016) Towards advanced structural analysis of iron oxide clusters on the surface of γ-Al |
Neff JL, Milde P, León CP, et al. (2014) Epitaxial growth of pentacene on alkali halide surfaces studied by Kelvin probe force microscopy. Acs Nano. 8: 3294-301 |
Kundrat MD, Autschbach J. (2009) Modeling of the Chiroptical Response of Chiral Amino Acids in Solution Using Explicit Solvation and Molecular Dynamics. Journal of Chemical Theory and Computation. 5: 1051-60 |
Kundrat MD, Autschbach J. (2008) Ab Initio and Density Functional Theory Modeling of the Chiroptical Response of Glycine and Alanine in Solution Using Explicit Solvation and Molecular Dynamics. Journal of Chemical Theory and Computation. 4: 1902-14 |
Kundrat MD, Autschbach J. (2008) Computational modeling of the optical rotation of amino acids: a new look at an old rule for pH dependence of optical rotation. Journal of the American Chemical Society. 130: 4404-14 |
Krykunov M, Kundrat MD, Autschbach J. (2006) Calculation of circular dichroism spectra from optical rotatory dispersion, and vice versa, as complementary tools for theoretical studies of optical activity using time-dependent density functional theory. The Journal of Chemical Physics. 125: 194110 |
Kundrat MD, Autschbach J. (2006) Time dependent density functional theory modeling of specific rotation and optical rotatory dispersion of the aromatic amino acids in solution. The Journal of Physical Chemistry. A. 110: 12908-17 |
Kundrat MD, Autschbach J. (2006) Time dependent density functional theory modeling of chiroptical properties of small amino acids in solution. The Journal of Physical Chemistry. A. 110: 4115-23 |