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Llistar Títols per Matèria "Química computacional"

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Format	Data	Títol	Autor
Format	Data	Títol	Autor
	7 maig 2018	Computational chemistry applied to hydrocarbon functionalization by iron catalysts, oxidation state characterization, and electrides design	Postils Ribó, Verònica
	14 gener 2020	Computational mechanistic studies of C-H and C-X activated organometallic species with first-row transition metals	Roldán Gómez, Steven
	17 novembre 2017	Computational study of nuclear magnetic shielding constants	Castro Aguilera, Abril Carolina
	27 març 2023	Development and application of new methodologies for chemical bonding analysis	Gimferrer Andrés, Martí
	7 juliol 2006	Development, implementation and application of electronic structural descriptors to the analysis of the chemical bonding, aromaticity and chemical reactivity	Matito i Gras, Eduard
		Development, implementation and application of electronic structural descriptors to the analysis of the chemical bonding, aromaticity and chemical reactivity	Matito i Gras, Eduard
	21 octubre 2010	Dihydrogen bonds: a study	Hugas Germà, David
		Dihydrogen bonds: a study	Hugas Germà, David
	2 juny 2008	Enhancing learning beyond the classroom: blogging and other social networking tools	Duran i Portas, Miquel ; Simon i Rabasseda, Sílvia ; Guillaumes Domenèch, Laia ; Sodupe Roure, Mariona ; Ríos Font, Raquel ; Constantino Aguilella, Erika
	2 juny 2008	Enhancing learning beyond the classroom: blogging and other social networking tools	Duran i Portas, Miquel ; Simon i Rabasseda, Sílvia ; Guillaumes Domènech, Laia ; Sodupe Roure, Mariona ; Ríos Font, Raquel ; Constantino Aguilella, Erika
		Enhancing learning beyond the classroom: blogging and other social networking tools	Duran i Portas, Miquel ; Simon i Rabasseda, Sílvia ; Guillaumes Domènech, Laia ; Sodupe Roure, Mariona ; Ríos Font, Raquel ; Constantino Aguilella, Erika
	10 desembre 2021	Enzymatic and bioinspired iron oxidation chemistry: a computational study	D’Amore, Lorenzo
	14 maig 2024	Exploring the boundaries of aromaticity through computational analysis of excited states and complex molecular topologies	Escayola Gordils, Sílvia
	20 maig 2024	Oriented external electric fields in chemistry: development and application of new methods to simulate molecular response properties and reactivity	Besalú Sala, Pau
	20 abril 2018	Rhodium-catalysed [2+2+2] cycloaddition reactions for the preparation of highly functionalised cyclic compounds	Cassú Ponsatí, Daniel
	30 setembre 2003	Single and multiple addition to C60. A computational chemistry study	Cases Amat, Montserrat
		Single and multiple addition to C60. A computational chemistry study	Cases Amat, Montserrat
	29 maig 2015	Structure and reactivity of endohedral (metallo)fullerenes	Garcia Borràs, Marc
		Structure and reactivity of endohedral (metallo)fullerenes	Garcia Borràs, Marc
	26 març 2010	Theoretical studies of the exohedral reactivity of fullerene compounds	Osuna Oliveras, Sílvia
		Theoretical studies of the exohedral reactivity of fullerene compounds	Osuna Oliveras, Sílvia

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