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Professor Yarkony has been interested in nonadiabatic chemistry since 1985 when he, in collaboration with Byron Lengsfield and Paul Saxe, reported to a unique algorithm for determining the first derivative or momentum coupling for multireference configuration interactions wave function using analytic gradient techniques. This lead Yarkony, in the 1990's to develop algorithms to locate and characterize conical intersections of states of the same symmetry. These algorithms have shaped his career as he and several other groups have demonstrated that such conical intersections are ubiquitous and must be considered in any ultrafast nonadiabatic process.
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Springer Handbook of Atomic, Molecular, and Optical PhysicsSpringer Handbookspp.487-506, (2023)
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JOURNAL OF PHYSICAL CHEMISTRY LETTERSno. 47 (2023): 10517-10530
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