Dr. Christian Neiß


Lehrstuhl für Theoretische Chemie

Mitarbeit in Forschungsprojekten

SFB 953: Synthetische Kohlenstoffallotrope
Prof. Dr. Andreas Hirsch

Publikationen (Download BibTeX)

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Tew, D.P., Klopper, W., Neiß, C., & Haettig, C. (2007). Quintuple-ζ quality coupled-cluster correlation energies with triple-ζ basis sets. Physical Chemistry Chemical Physics, 9(16), 1921-1930. https://dx.doi.org/10.1039/b617230j
Neiß, C. (2007). Synthesis, characterization and quantum mechanical calculations of [Au 18Se8(dppthph)6]Cl2. European Journal of Inorganic Chemistry, 33, 5163-5167. https://dx.doi.org/10.1002/ejic.200700870
Neiß, C. (2006). Extensions of r12 corrections to CC2-R12 for excited states. Journal of Chemical Physics, 125(6). https://dx.doi.org/10.1063/1.2335443
Neiß, C., & Saalfrank, P. (2004). Molecular dynamics simulation of the LOV2 domain from adiantum capillus-veneris. Journal of Chemical Information and Computer Sciences, 44(5), 1788-1793. https://dx.doi.org/10.1021/ci049883u
Neiß, C., & Saalfrank, P. (2003). Ab Initio Quantum Chemical Investigation of the First Steps of the Photocycle of Phototropin: A Model Study. Photochemistry and Photobiology, 77(1), 101-109. https://dx.doi.org/10.1562/0031-8655(2003)077<0101:AIQCIO>2.0.CO;2

Zuletzt aktualisiert 2016-05-05 um 05:04