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职业迁徙
个人简介
I like to develop new methodology and new codes to better understand molecular structure and chemical reactivity. My main areas of application are (a) Basis set superposition error in weak molecular complexes, (b) One- and two-electron density analysis, and (c) Effects of electric fields and nonlinear optical properties of molecules. Other areas of research involve (d) Fullerenes, (e) Bioinorganic systems, and (f) Conceptual density functional tehory.
With Prof. Miquel Solà we co-lead the research group "Molecular Modeling and Quantum Chemical Methodology", which gathers ca. 20 researchers, one half of them graduate students.
研究兴趣
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Josep Duran, Pep Anton Vieta,Julià Fernández-Martínez,Albert Poater,Miquel Duran,Sílvia Simon,Jaume Ametller, Pere Cornellà
INTED2022 ProceedingsINTED Proceedings (2022)
EDEN Conference Proceedingspp.137-142, (2020)
The Journal of Organic Chemistryno. 23 (2019): 15538-15548
12TH INTERNATIONAL CONFERENCE OF EDUCATION, RESEARCH AND INNOVATION (ICERI2019) (2019)
Silvia Simon,Pepus Daunis-I-Estadella, Lino Montoro, Meritxell Estebanell, Enric Verdu,Miquel Duran,Josep Duran, Dani Macaya
12TH INTERNATIONAL CONFERENCE OF EDUCATION, RESEARCH AND INNOVATION (ICERI2019) (2019)
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