Valence Shell Electron Pair Repulsion simulator
Tools | 06 Dec 2009 | Contributor(s): Baudilio Tejerina
This tool calculates the optimal distribution of particles subject to a Coulombic potential on the surface of a sphere.
UV/Vis Spectra simulator
Tools | 04 Mar 2008 | Contributor(s): Baudilio Tejerina
This tool computes molecular electronic spectra.
Theoretical Electron Density Visualizer
Tools | 01 Jul 2008 | Contributor(s): Baudilio Tejerina
TEDVis calculates and displays 3D maps of molecular ED and its derivatives from the wave function.
Theoretical Analysis of Gold Nanoparticles
Teaching Materials | 04 May 2009 | Contributor(s): Jon Camden, George C. Schatz, Baudilio Tejerina
All physical and chemical properties are size dependent, and the properties of materials on the nanosize scale have important consequences in wide ranging fields. Exploiting nanoscale behavior will eventually lead scientists to develop devices that can selectively attack diseased cells, increase...
QC-Lab
Tools | 14 Feb 2006 | Contributor(s): Baudilio Tejerina
Quantum Chemsitry Lab: Ab Initio and DFT molecular and electronic structure calculations of small molecules
Top 5 shown | See more results
NCN at Northwestern Tools
site
NCN@Northwestern Tool Support We have identified a list of tools for which we commit the following level of service: monitor support tickets, questions, and wishlists and provide a response within one business day. fix simple bugs within a week. move long term projects and tool...
Introduction to Quantum Chemistry and Molecular Modeling.
This course is intended to introduce the students to concepts of theoretical chemistry and molecular modeling. A practical approach will be used guiding the student from the fundamental theoretical background to the practical aspects of the models: definition, analysis and interpretation. The...
Simulation of laser devices with ActiveMedia nanophotonics tool (ACME NPDS)
This tutorial is intended to demonstrate how to build a device and analyze its optical properties and lasing behavior.
Top 3 shown