A Computational Experiment Introducing Undergraduates to Geometry Optimizations, Vibrational Frequencies, and Potential Energy Surfaces-Reference-Cited by-同舟云学术

A Computational Experiment Introducing Undergraduates to Geometry Optimizations, Vibrational Frequencies, and Potential Energy Surfaces

Author:

Hanson Matthew D.¹^ORCID,Miller Daniel P.²^ORCID,Kondeti Cholavardhan¹,Brown Adam³,Zurek Eva⁴^ORCID,Simpson Scott¹^ORCID

Affiliation:

1. Department of Chemistry, St. Bonaventure University, St. Bonaventure, New York14778, United States

2. Department of Chemistry, Hofstra University, Hempstead, New York11549, United States

3. Department of Education, St. Bonaventure University, St. Bonaventure, New York14778, United States

4. Department of Chemistry, State University of New York at Buffalo, Buffalo, New York14260, United States

Funder

Division of Chemistry

American Chemical Society Petroleum Research Fund

Division of Chemical, Bioengineering, Environmental, and Transport Systems

Hofstra University

Publisher

American Chemical Society (ACS)

Subject

Education,General Chemistry

Link

Reference31 articles.

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