ACS, Articles, Computational Chemistry, DFT, Drug Delivery, JCTC, Molecular Dynamics, NBO, Paper, Theoretical Chemistry

New paper in Journal of Chemical Theory and Computation

January 9, 2014 — 13 Comments

Articles, Computational Chemistry, Paper, TD-DFT, Theoretical Chemistry

New paper in J. Phys. Chem. C

April 19, 2013 — 7 Comments

Articles, Chemistry, Computational Chemistry, CONACyT, Mathematics, Teaching

Article in ‘Ciencia y Desarrollo’ (Science and Development)

March 27, 2013 — 1 Comment

Articles, Computational Chemistry, Models, Paper, Quantum Mechanics, Research, Theoretical Chemistry

The Local Bond Order, LBO (Barroso et al. 2004)

August 6, 2012 — 1 Comment

Articles, Computational Chemistry, Journals, Paper, Theoretical Chemistry

Paper accepted to Journal of Inclusion Phenomena

April 28, 2012 — 2 Comments

Articles, Computational Chemistry, Journals, Science

Inorganic Chemistry paper

July 17, 2009 — 2 Comments