Difference between revisions of "Introduction to Computation Chemistry"

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[[Media:Ionization energy chart.pdf|Make this chart]]
 
[[Media:Ionization energy chart.pdf|Make this chart]]
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===Keto-Enol?===
  
 
===Calculation of Water vibrational Modes===
 
===Calculation of Water vibrational Modes===
  
 
===Calculation of UV-Vis for Conjugated Polyenes===
 
===Calculation of UV-Vis for Conjugated Polyenes===

Revision as of 18:14, 15 March 2018

This physical chemistry lab will introduce student to computational chemistry resources at Monmouth College.

WebMO 9.0

WebMO 9.0 Pro

WebMO 18.0

Introduction to WebMO

Setup WebMO Accounts

Calculation of Atomic Ionization Energies

Make this chart

Keto-Enol?

Calculation of Water vibrational Modes

Calculation of UV-Vis for Conjugated Polyenes