Electronic structure of dimetallocene molecules: Dizincocene Zn2(η5-C5Me5) 2

10.1016/j.theochem.2006.06.040

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Main Authors: Philpott, M.R., Kawazoe, Y.
Other Authors: MATERIALS SCIENCE
Format: Article
Published: 2014
Subjects:
Online Access:http://scholarbank.nus.edu.sg/handle/10635/107025
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spelling sg-nus-scholar.10635-1070252023-10-30T07:37:02Z Electronic structure of dimetallocene molecules: Dizincocene Zn2(η5-C5Me5) 2 Philpott, M.R. Kawazoe, Y. MATERIALS SCIENCE Density functional theory Dizincocene Electron localization function ELF Electronic structure Kohn-Sham level Partial charge density Quantum electronic structure Zincous ion Zn2 2 + 10.1016/j.theochem.2006.06.040 Journal of Molecular Structure: THEOCHEM 273 1-3 43-52 THEOD 2014-10-29T08:38:26Z 2014-10-29T08:38:26Z 2006-10-30 Article Philpott, M.R., Kawazoe, Y. (2006-10-30). Electronic structure of dimetallocene molecules: Dizincocene Zn2(η5-C5Me5) 2. Journal of Molecular Structure: THEOCHEM 273 (1-3) : 43-52. ScholarBank@NUS Repository. https://doi.org/10.1016/j.theochem.2006.06.040 01661280 http://scholarbank.nus.edu.sg/handle/10635/107025 000241754400007 Scopus
institution National University of Singapore
building NUS Library
continent Asia
country Singapore
Singapore
content_provider NUS Library
collection ScholarBank@NUS
topic Density functional theory
Dizincocene
Electron localization function ELF
Electronic structure
Kohn-Sham level
Partial charge density
Quantum electronic structure
Zincous ion Zn2 2 +
spellingShingle Density functional theory
Dizincocene
Electron localization function ELF
Electronic structure
Kohn-Sham level
Partial charge density
Quantum electronic structure
Zincous ion Zn2 2 +
Philpott, M.R.
Kawazoe, Y.
Electronic structure of dimetallocene molecules: Dizincocene Zn2(η5-C5Me5) 2
description 10.1016/j.theochem.2006.06.040
author2 MATERIALS SCIENCE
author_facet MATERIALS SCIENCE
Philpott, M.R.
Kawazoe, Y.
format Article
author Philpott, M.R.
Kawazoe, Y.
author_sort Philpott, M.R.
title Electronic structure of dimetallocene molecules: Dizincocene Zn2(η5-C5Me5) 2
title_short Electronic structure of dimetallocene molecules: Dizincocene Zn2(η5-C5Me5) 2
title_full Electronic structure of dimetallocene molecules: Dizincocene Zn2(η5-C5Me5) 2
title_fullStr Electronic structure of dimetallocene molecules: Dizincocene Zn2(η5-C5Me5) 2
title_full_unstemmed Electronic structure of dimetallocene molecules: Dizincocene Zn2(η5-C5Me5) 2
title_sort electronic structure of dimetallocene molecules: dizincocene zn2(η5-c5me5) 2
publishDate 2014
url http://scholarbank.nus.edu.sg/handle/10635/107025
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