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Theoretical Study of Small (NaI) n Clusters

✍ Scribed by Aguado, A.; Ayuela, A.; López, J. M.; Alonso, J. A.


Book ID
127244606
Publisher
American Chemical Society
Year
1997
Tongue
English
Weight
173 KB
Volume
101
Category
Article
ISSN
0022-3654

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Theoretical study of small gallium arsen
✍ Mohammad A. Al-Laham; Krishnan Raghavachari 📂 Article 📅 1991 🏛 Elsevier Science 🌐 English ⚖ 689 KB

Electronic structures and stabilities of Ga,As, clusters (n= l-3) are explored by means of accurate quantum-chemical calculations using ab initio effective core potentials (ECP). Our results on GaAs and Ga2As2 are in good agreement with the conclusions from previous studies on these systems. We find