Name
Abstract | ||
|---|---|---|
Regions of space are defined to maximize the probability to find a given number of electrons within. Their chemical significance and their relationship to the electron localization function (ELF) are explored by analyzing the results for a few linear molecules: LiH, BH, N-2, CO, CS, C2H2, and C4H2. (c) 2005 Wiley Periodicals, Inc. J Comput Chem 26: 455-460, 2005. |
Year | DOI | Venue |
|---|---|---|
2005 | 10.1002/jcc.20180 | JOURNAL OF COMPUTATIONAL CHEMISTRY |
Keywords | Field | DocType |
maximal probability domains,linear molecules,electron localization function (ELF) | Linear molecular geometry,Computational chemistry,Electron localization function,Mathematics,Electron | Journal |
Volume | Issue | ISSN |
26 | 5 | 0192-8651 |
Citations | PageRank | References |
3 | 1.40 | 0 |
Authors | ||
5 | ||
Name | Order | Citations | PageRank |
|---|---|---|---|
| A Gallegos | 1 | 6 | 2.27 |
| Ramon Carbó-Dorca | 2 | 199 | 28.14 |
| F Lodier | 3 | 3 | 1.40 |
| Eric Cancès | 4 | 43 | 10.31 |
| Andreas Savin | 5 | 11 | 3.28 |