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1. PARTIAL CHARGE CORRELATION FUNCTION DEFINITION OF THEORETICAL BOND ORDER, AND ITS COMPUTATION FROM EFFECTIVE MINIMAL BASIS SETS

open_access
Open Access
Author:
Bintrim, Sylvia
Title:
PARTIAL CHARGE CORRELATION FUNCTION DEFINITION OF THEORETICAL BOND ORDER, AND ITS COMPUTATION FROM EFFECTIVE MINIMAL BASIS SETS
Area of Honors:
Chemistry
Keywords:
covalent bond
computational chemistry
bond order
quantum chemistry
File:
Download final_Bintrim_thesis.pdf
Thesis Supervisors:
Gerald Knizia, Thesis Supervisor
Przemyslaw Maslak, Thesis Honors Advisor