J
James E. Friedheim
Researcher at University of Texas at Austin
Publications - 3
Citations - 127
James E. Friedheim is an academic researcher from University of Texas at Austin. The author has contributed to research in topics: MNDO & Molecular orbital. The author has an hindex of 3, co-authored 3 publications receiving 126 citations.
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Revised MNDO parameters for silicon
TL;DR: In this article, MNDO has been reparametrized for silicon and the results for a wide variety of silicon-containing compounds are compared with results from recent high level ab initio calculations.
Journal ArticleDOI
Calculation of energies of excited states using MNDO
Michael J. S. Dewar,Marye Anne Fox,Kay A. Campbell,Chia-Chung Chen,James E. Friedheim,Mary K. Holloway,Shi Choon Kim,Phillip B. Liescheski,Ali M. Pakiari,Tze-Pei Tien,Eve G. Zoebisch +10 more
TL;DR: In this article, the lowest singlet (S1) and triplet (T1) states of 28 molecules have been calculated by the half-electron (MNDO-HE) and spin-unrestricted (UMNDO) versions of MNDO.