Luis Manuel
Frutos Gaite
Catedrático/a de Universidad
Ignacio
Fernández Galván
Publicaciones en las que colabora con Ignacio Fernández Galván (4)
2019
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OpenMolcas: From Source Code to Insight
Journal of Chemical Theory and Computation, Vol. 15, Núm. 11, pp. 5925-5964
2017
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How Do Methyl Groups Enhance the Triplet Chemiexcitation Yield of Dioxetane?
Journal of Physical Chemistry Letters, Vol. 8, Núm. 16, pp. 3790-3794
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Optomechanical Control of Quantum Yield in Trans–Cis Ultrafast Photoisomerization of a Retinal Chromophore Model
Angewandte Chemie International, Vol. 56, Núm. 14, pp. 3842-3846
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