Computational Chemistry, Gaussian, Models, Quantum Mechanics, Science, Theoretical Chemistry, White papers

Polarizability and Hyperpolarizability in Gaussian

July 27, 2012 — 35 Comments

Articles, Computational Chemistry, Journals, Paper, Theoretical Chemistry

Paper accepted to Journal of Inclusion Phenomena

April 28, 2012 — 2 Comments

Computational Chemistry, Gaussian, Models, Software, Theoretical Chemistry, White papers

Polarizable Continuum Model (PCM) in G09 (Part II)

October 24, 2011 — 25 Comments

Computational Chemistry, Theoretical Chemistry, White papers

How to calculate Fukui indices

July 26, 2010 — 115 Comments

Computational Chemistry, Mathematics, Models, Theoretical Chemistry

Basis sets

January 28, 2010 — 3 Comments

Causality, History of science, Mathematics, Models, Nobel Prize, Proteins, Quantum Mechanics, Science, Theoretical Chemistry

Pauling hybridization model

June 1, 2009 — 2 Comments

Computational Chemistry, Science, Talks

MolMod ’09

March 12, 2009 — 0 Comments

Computational Chemistry, Science, Talks

Molmod ’09 at Babes-Bolyai University

March 10, 2009 — 0 Comments