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What to do about unpaired electrons? A hydrocarbon hexaradical with three Closs diradicals linked by 1,3,5-trimethylbenzene as ferromagnetic coupler
National licenceAmerican Institute of Physics | 2002| -
Toward subchemical accuracy in computational thermochemistry: Focal point analysis of the heat of formation of NCO and [H,N,C,O] isomers
National licenceAmerican Institute of Physics | 2004| -
The highly anharmonic BH5 potential energy surface characterized in the ab initio limit
Online Contents | 2005| -
The highly anharmonic BH5 potential energy surface characterized in the ab initio limit
National licenceAmerican Institute of Physics | 2005| -
On the characterization of three state conical intersections: A quasianalytic theory using a group homomorphism approach
National licenceAmerican Institute of Physics | 2006| -
On the Characterization of Three-State Conical Intersections Using a Group Homomorphism Approach: The Two-State Degeneracy Spaces †
American Chemical Society | 2006| -
On the characterization of three state conical intersections using a group homomorphism approach: Mapping the full N−5 dimensional seam space
National licenceAmerican Institute of Physics | 2006| -
On the vibronic coupling approximation: A generally applicable approach for determining fully quadratic quasidiabatic coupled electronic state Hamiltonians
National licenceAmerican Institute of Physics | 2007| -
On the locus of points of conical intersection: Seams near seams
National licenceAmerican Institute of Physics | 2007| -
On the simulation of photoelectron spectra in molecules with conical intersections and spin-orbit coupling: The vibronic spectrum of CH3S
National licenceAmerican Institute of Physics | 2007|
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