Ignacio Fernández Galván-rekin lankidetzan egindako argitalpenak (4)

2019

  1. OpenMolcas: From Source Code to Insight

    Journal of Chemical Theory and Computation, Vol. 15, Núm. 11, pp. 5925-5964

2017

  1. How Do Methyl Groups Enhance the Triplet Chemiexcitation Yield of Dioxetane?

    Journal of Physical Chemistry Letters, Vol. 8, Núm. 16, pp. 3790-3794

  2. 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

  1. Molcas 8: New capabilities for multiconfigurational quantum chemical calculations across the periodic table

    Journal of Computational Chemistry, Vol. 37, Núm. 5, pp. 506-541