Química Cuántica

Resultados de investigación

Artigos de revista

Comunicación

Proxectos

Libros

Capítulos de libro

Tese

A Tetracyanobutadiene Spirobifluorene: Synthesis, Enantiomeric Resolution and Chiroptical Properties

Autores

Ozcelik, Ani

Pereira-Cameselle, Raquel

Peña-Gallego, Ángeles

Alonso-Gómez, J. Lorenzo

Revista

EUROPEAN JOURNAL OF ORGANIC CHEMISTRY Vol. 2022

DOI

10.1002/EJOC.202101333

ON/OFF Spiroconjugation through Peripheral Functionalization: Impact on the Reactivity and Chiroptical Properties of Spirobifluorenes

Autores

Ozcelik, Ani

Aranda, Daniel

Pereira-Cameselle, Raquel

Talavera, María

Covelo, Berta

Santoro, Fabrizio

Peña-Gallego, Ángeles

Alonso-Gómez, J. Lorenzo

Revista

ChemPlusChem Vol. 87

DOI

10.1002/CPLU.202100554

Optical and electrochemical properties of spirobifluorene iridanaphthalene complexes

Autores

Talavera, María

Pereira-Cameselle, Raquel

Peña-Gallego, Ángeles

Vázquez-Carballo, Irene

Prieto, Inmaculada

Alonso-Gómez, J. Lorenzo

Bolaño, Sandra

Revista

DALTON TRANSACTIONS Vol. 52 (páxinas 487 a 493)

DOI

10.1039/D2DT03465D

Confinement on the optical response in h-BNCs: Towards highly efficient SERS-active 2D substrates

Autores

Marcos Mandado

Nicolás Ramos-Berdullas

Revista

Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy Vol. 266 (páxinas 120451 a 120451)

DOI

10.1016/j.saa.2021.120451

Achieving S2- in aqueous solution: an evaluation using First-Principle molecular dynamics simulations

Autores

MARTA QUEIZAN CORES

ANA MARIA GRAÑA RODRIGUEZ

JOSE MANUEL HERMIDA RAMON

Revista

JOURNAL OF MOLECULAR LIQUIDS Vol. 349 (páxinas 118109 a 118109)

DOI

10.1016/j.molliq.2021.118109

Estudio computacional del calor de combustión del naftaleno: Otra forma de hacer prácticas de laboratorio.

Congreso

VI Congreso Internacional de Docencia Universitaria - CINDU 2019

Ámbito

Internacional

Autores

Jose M. Hermida-Ramón

Mandado, M.

Nicolás Otero

Peña-Gallego, A

Cidade

Vigo (España)

TEACHING CHEMICAL BONDING THROUGH PROJECT-BASED LEARNING. II. WEIGHTING KNOW HOW AND KNOW WHY WITHIN THE PROJECTS

Congreso

11th International Conference on Education and New Learning Technologies

Ámbito

Internacional

Autores

Mosquera, Ricardo A.

Estévez, L.

Peña-Gallego, A

Losada-Barreiro, S.

Bravo-Díaz, C.

Cidade

Palma (España)

DOI

0.21125/edulearn.2019

Datos xerais

Contact

Ámbito de investigación

Membros de grupo

Resultados de investigación

A Tetracyanobutadiene Spirobifluorene: Synthesis, Enantiomeric Resolution and Chiroptical Properties

ON/OFF Spiroconjugation through Peripheral Functionalization: Impact on the Reactivity and Chiroptical Properties of Spirobifluorenes

Optical and electrochemical properties of spirobifluorene iridanaphthalene complexes

Confinement on the optical response in h-BNCs: Towards highly efficient SERS-active 2D substrates

Achieving S2- in aqueous solution: an evaluation using First-Principle molecular dynamics simulations

Estudio computacional del calor de combustión del naftaleno: Otra forma de hacer prácticas de laboratorio.

TEACHING CHEMICAL BONDING THROUGH PROJECT-BASED LEARNING. II. WEIGHTING KNOW HOW AND KNOW WHY WITHIN THE PROJECTS

Chirales Inteligentes para Hidrógeno Eficiente

Aromaticity: Exploring Basic Chemical Concepts with the Quantum Theory of Atoms in Molecules

Graphene Molecules as Platforms for SERS Detection: A Future Perspective

Estudo teórico-computacional do transporte electrónico en sistemas con base de carbono