Iterative estimation of total p-electron energy

Abstract: In this work, the lower and upper bounds for total p-electron energy (E) was studied. Amethod is presented, by means of which, starting with a lower bound EL and an upper bound EU for E, a sequence of auxiliary quantities E0, E1, E2, … is computed, such that E0 = EL, E0 < E1 < E2 <...

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Bibliographic Details
Main Authors: LEMI TÜRKER, IVAN GUTMAN
Format: Article
Language:English
Published: Serbian Chemical Society 2005-10-01
Series:Journal of the Serbian Chemical Society
Subjects:
Online Access:http://www.shd.org.yu/HtDocs/SHD/vol70/No10/JSCS_V70_No10-08.pdf