All Categories (1-3 of 3)

1. 

   Baudilio Tejerina

   Since November 2004, Baudilio Tejerina manages the computer facilities of the Theory Group in the Department of Chemistry at Northwestern University. After receiving his PhD in Physical Chemistry...

   https://nanohub.org/members/8744

2. Sep 09 2022

   Introduction to computational chemistry using the NUITNS simulation toolkit in nanoHUB

   Introduction to computational chemistry using the NUITNS simulation toolkit in nanoHUBDate and TimeSeptember 9, 2022; 1:00 - 2:00 PM EDTPresenterTomekia Simeon, Ph.D., Assistant Professor at...

   https://nanohub.org/events/details/2231

3. Optical and Thermodynamic properties of noble metal nanoparticles. Effect of chemical functionalization.

   06 May 2009 | Contributor(s):: Baudilio Tejerina, George C. Schatz

   This laboratory is intended to introduce the student to the use of semiempirical electronic structure methods. In particular, the semiempirical methods will be applied to the study of metallic clusters and the interaction of the clusters with molecules such as pyridine. The reactivity of the...