PD Dr. Andreas Heßelmann



Organisation


Lehrstuhl für Theoretische Chemie


Publications (Download BibTeX)

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Jordan, K.D., & Heßelmann, A. (2019). Comment on "physisorption of Water on Graphene: Subchemical Accuracy from Many-Body Electronic Structure Methods". Journal of Physical Chemistry C, 123(15), 10163-10165. https://dx.doi.org/10.1021/acs.jpcc.9b02326
Kriebel, M., Heßelmann, A., Hennemann, M., & Clark, T. (2019). Correction to: The Feynman dispersion correction for MNDO extended to F, Cl, Br and I (Journal of Molecular Modeling, (2019), 25, 6, (156), 10.1007/s00894-019-4038-z). Journal of Molecular Modeling, 25(9). https://dx.doi.org/10.1007/s00894-019-4142-0
Heßelmann, A., & Ferraro, F. (2019). Study of the Wilcox torsion balance in solution for a Troger's base derivative with hexyl-and heptyl substituents using a combined molecular mechanics and quantum chemistry approach. Journal of Molecular Modeling, 25(3). https://dx.doi.org/10.1007/s00894-019-3935-5
Kriebel, M., Heßelmann, A., Hennemann, M., & Clark, T. (2019). The Feynman dispersion correction for MNDO extended to F, Cl, Br and I. Journal of Molecular Modeling, 25(6). https://dx.doi.org/10.1007/s00894-019-4038-z
Clark, T., & Heßelmann, A. (2018). The coulombic sigma-hole model describes bonding in CX3I center dot center dot center dot Y- complexes completely. Physical Chemistry Chemical Physics, 20(35), 22849-22855. https://dx.doi.org/10.1039/c8cp03079k
Sharapa, D., Margraf, J.T., Heßelmann, A., & Clark, T. (2017). Accurate Intermolecular Potential for the C-60 Dimer: The Performance of Different Levels of Quantum Theory. Journal of Chemical Theory and Computation, 13(1), 274-285. https://dx.doi.org/10.1021/acs.jctc.6b00869
Esterhuysen, C., Heßelmann, A., & Clark, T. (2017). Trifluoromethyl: An Amphiphilic Noncovalent Bonding Partner. Chemphyschem, 18(7), 772-784. https://dx.doi.org/10.1002/cphc.201700027
Elkerdawy, A., Murray, J.S., Politzer, P., Bleiziffer, P., Heßelmann, A., Görling, A., & Clark, T. (2013). Directional noncovalent interactions: Repulsion and dispersion. Journal of Chemical Theory and Computation, 9(5), 2264-2275. https://dx.doi.org/10.1021/ct400185f
Bleiziffer, P., Heßelmann, A., & Görling, A. (2013). Efficient self-consistent treatment of electron correlation within the random phase approximation. Journal of Chemical Physics, 139(8). https://dx.doi.org/10.1063/1.4818984
Bleiziffer, P., Heßelmann, A., Umrigar, C.J., & Görling, A. (2013). Influence of the exchange-correlation potential in methods based on time-dependent density-functional theory. Physical Review A, 88(4). https://dx.doi.org/10.1103/PhysRevA.88.042513

Last updated on 2016-12-05 at 05:06