JAVIER
SEGARRA MARTI
INVEST CONT RAMON Y CAJAL
ANGELO
GIUSSANI -
AYUDANTE DOCTOR/A
Publicaciones en las que colabora con ANGELO GIUSSANI - (13)
2024
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XMS-CASPT2//XMS-CASPT2 and XMS-CASPT2//CASSCF at comparison: The impact of dynamic correlation in the excited state optimization of nitronaphthalene
Journal of Chemical Physics, Vol. 161, Núm. 1
2023
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Nonlinear spectroscopies
Theoretical and Computational Photochemistry: Fundamentals, Methods, Applications and Synergy with Experimental Approaches (Elsevier), pp. 417-445
2021
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Photochemistry, chemiluminescence and dark photochemistry: Computational advances (2018-2019)
Photochemistry (Royal Society of Chemistry), pp. 24-70
2019
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Quantum chemistry of the excited state: Recent trends in methods developments and applications
Photochemistry, Vol. 46, pp. 28-77
2018
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Light induced damage and repair in nucleic acids and proteins: General discussion
Faraday Discussions
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Two-dimensional electronic spectroscopy as a tool for tracking molecular conformations in DNA/RNA aggregates
Faraday Discussions, Vol. 207, pp. 233-250
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
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Multiple Decay Mechanisms and 2D-UV Spectroscopic Fingerprints of Singlet Excited Solvated Adenine-Uracil Monophosphate
Chemistry - A European Journal, Vol. 22, Núm. 22, pp. 7497-7507
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Spectroscopic fingerprints of DNA/RNA pyrimidine nucleobases in third-order nonlinear electronic spectra
Theoretical Chemistry Accounts, Vol. 135, Núm. 5
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Ultraviolet vision: photophysical properties of the unprotonated retinyl Schiff base in the Siberian hamster cone pigment
Theoretical Chemistry Accounts, Vol. 135, Núm. 4
2015
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Excitation of nucleobases from a computational perspective I: Reaction paths
Topics in Current Chemistry, Vol. 355, pp. 57-98
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Modeling the high-energy electronic state manifold of adenine: Calibration for nonlinear electronic spectroscopy
Journal of Chemical Physics, Vol. 142, Núm. 21
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Probing deactivation pathways of DNA nucleobases by two-dimensional electronic spectroscopy: First principles simulations
Faraday Discussions, Vol. 177, pp. 345-362