| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5394330 | Computational and Theoretical Chemistry | 2012 | 7 Pages |
Abstract
⺠Benchmark calculations of electronic structures of protonated rare gas clusters, [NeHHe]+, [ArHHe]+, and [ArHNe]+ are presented. ⺠In addition to the most stable structures (with hydrogen in the middle), two additional local minima are located. ⺠Harmonic frequencies of all the structures are reported.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
![Ab initio electronic structure investigation of protonated mixed rare gas dimers [NeHHe]+, [ArHHe]+ and [ArHNe]+](/preview/png/5394330.png "First Page Preview: Ab initio electronic structure investigation of protonated mixed rare gas dimers [NeHHe]+, [ArHHe]+ and [ArHNe]+")
Authors
Debasish Koner, Anurag Vats, Manish Vashishta, Aditya N. Panda,