Sending report ...Tags: MO theory
Resources
Tools
- 7.3 Ranking Tejerina: UV/Vis Spectra simulator
-
6.2 Ranking Tejerina: CNDO/INDO
CNDO/INDO
Type Tools Contributor(s) Baudilio Tejerina, Jeff Reimers Date 29 Feb. 2008 Avg. Rating (0) Rate this Semi-empirical Molecular Orbital calculations.
- 5.9 Ranking Tejerina: Theoretical Electron Density ...
- 5.3 Ranking Tejerina: Northwestern University Initiative ...
Teaching Materials
-
10.0 Ranking Bonilla: Molecular Orbital Theory
Molecular Orbital Theory
Type Teaching Materials Contributor(s) Luis Emmanuel Bonilla Date 18 Dec. 2006 Avg. Rating (0) Rate this This is the seventh contribution from the students in the University of Texas at El Paso Molecular Electronics course given in the fall of 2006. Luis Bonilla and Abel Perez have designed a presentation on molecular orbital theory for high school students.Abel Perez: I obtained my BS at Instituto ...
-
10.0 Ranking Grossman: Computational Nanoscience, Lecture ...
Computational Nanoscience, Lecture 4: Geometry Optimization and Seeing What You're Doing
Type Teaching Materials Contributor(s) Jeffrey C Grossman, Elif Ertekin Date 13 Feb. 2008 Avg. Rating (1) Rate this In this lecture, we discuss various methods for finding the ground state structure of a given system by minimizing its energy. Derivative and non-derivative methods are discussed, as well as the importance of the starting guess and how to find or generate good initial structures. We also briefly ...
Popular Questions with this Tag
No questions found.
Open Questions with this Tag
No questions found.
Related Topic Pages
The following are topic pages tagged with "motheory" that were posted by other users in our topics wiki.
No pages found.