Reactividad y Estructura Molecular ; Reactivity and Molecular Structure Group
RESMOL
University of Minnesota
Mineápolis, Estados UnidosPublicaciones en colaboración con investigadores/as de University of Minnesota (2)
2019
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OpenMolcas: From Source Code to Insight
Journal of Chemical Theory and Computation, Vol. 15, Núm. 11, pp. 5925-5964
2016
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Molcas 8: New capabilities for multiconfigurational quantum chemical calculations across the periodic table
Journal of Computational Chemistry, Vol. 37, Núm. 5, pp. 506-541