Luis Manuel
Frutos Gaite
Catedrático/a de Universidad
Miguel Ángel
Fernández González
Publicacions en què col·labora amb Miguel Ángel Fernández González (6)
2021
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The concept of substituent-induced force in the rationale of substituent effect
Journal of Chemical Physics, Vol. 154, Núm. 22
2018
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C-H Functionalization of BN-Aromatics Promoted by Addition of Organolithium Compounds to the Boron Atom
Organic Letters, Vol. 20, Núm. 16, pp. 4902-4906
2014
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Toward an optomechanical control of photoswitches by tuning their spectroscopical properties: Structural and dynamical insights into Azobenzene
Journal of Chemical Theory and Computation, Vol. 10, Núm. 1, pp. 312-323
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Tuning molecular excitation energy with external forces
Computational and Theoretical Chemistry, Vol. 1040-1041, pp. 106-111
2012
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Modulating nitric oxide release by S-nitrosothiol photocleavage: Mechanism and substituent effects
Journal of Physical Chemistry A, Vol. 116, Núm. 26, pp. 7039-7049
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Structural substituent effect in the excitation energy of a chromophore: Quantitative determination and application to S-nitrosothiols
Journal of Chemical Theory and Computation, Vol. 8, Núm. 9, pp. 3293-3302