English  |  正體中文  |  简体中文  |  全文筆數/總筆數 : 6507/11669
造訪人次 : 29938248      線上人數 : 523
RC Version 3.2 © Powered By DSPACE, MIT. Enhanced by NTU Library IR team.
搜尋範圍 進階搜尋

請使用永久網址來引用或連結此文件: http://ir.ncue.edu.tw/ir/handle/987654321/10034

題名: Is Dodecahedral P20 Special ?
作者: Hu, Ching-Han;Shen, M.;Schaefer, H. F.
貢獻者: 化學系
關鍵詞: Phosphorus clusters - P20 - Dodecahedra
日期: 1994-03
上傳時間: 2012-05-03T06:15:47Z
出版者: SpringerLink
摘要: The laboratory study of phosphorus clusters by laser-based mass spectrometric methods indicates, tentatively, that P + 21 may be special. A plausible interpretation might place a P+ ion interior to a dodecahedral P20 molecule.Ab initio quantum mechanical methods have been applied to the P20 molecule using contracted gaussian basis sets as large as (9s 6p 4d 3f) on each phosphorus atom. At the highest level of theory, dodecahedral P20 is predicted to lie 23 kcal/mol above five separated P4 molecules.
關聯: Theoretica Chimica Acta, 88(1): 29-33
顯示於類別:[化學系] 期刊論文

文件中的檔案:

檔案 大小格式瀏覽次數
2020400410071.pdf26KbAdobe PDF536檢視/開啟


在NCUEIR中所有的資料項目都受到原著作權保護.

 

DSpace Software Copyright © 2002-2004  MIT &  Hewlett-Packard  /   Enhanced by   NTU Library IR team Copyright ©   - 回饋