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The Journal of Chemical Physics|February 18, 2026
Accurate diabatic potential energy model for NO3 including spin-orbit couplingFabian Fritsch, Wolfgang EisfeldThe Journal of Physical Chemistry. A|May 15, 2024
Compensation States Approach in the Hybrid Diabatization Scheme: Extension to Multidimensional Data and PropertiesNicole Weike, Fabian Fritsch, Wolfgang EisfeldThe Journal of Chemical Physics|February 9, 2022
A general method for the development of diabatic spin-orbit models for multi-electron systemsFabian Fritsch, Thomas Weike, Wolfgang EisfeldThe Journal of Physical Chemistry. A|March 17, 2006
Calculation of the vibrationally resolved electronic absorption spectrum of the propargyl radical (H2CCCH)Wolfgang EisfeldThe Journal of Chemical Physics|February 10, 2011
Highly accurate determination of the electron affinity of SF6 and analysis of structure and photodetachment spectrum of SF6-Wolfgang EisfeldPhysical Chemistry Chemical Physics : PCCP|October 9, 2009
Ab initio calculation of electronic absorption spectra and ionization potentials of C3H3 radicalsWolfgang EisfeldPhysical Chemistry Chemical Physics : PCCP|October 2, 2009
Theoretical study of the photodetachment spectrum of the methylene amidogene anion (H2CN-)Wolfgang EisfeldThe Journal of Chemical Physics|July 23, 2004
Theoretical investigation of ground and excited states of the methylene amidogene radical (H(2)CN)Wolfgang EisfeldThe Journal of Chemical Physics|January 23, 2017
Vibronic eigenstates and the geometric phase effect in the <sup>2</sup>E″ state of NO<sub>3</sub>Wolfgang Eisfeld, Alexandra VielThe Journal of Chemical Physics|February 11, 2024
The effective relativistic coupling by asymptotic representation approach for molecules with multiple relativistic atomsNicole Weike, Wolfgang EisfeldPageof 5