𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Valence bond study of the fragmentation of C2v Li4− cluster

✍ Scribed by A. D. Quintão; R. O. Vianna

Publisher
John Wiley and Sons
Year
2000
Tongue
English
Weight
295 KB
Volume
81
Category
Article
ISSN
0020-7608

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Valence bond studies of the D2h isomer o
Valence bond studies of the D2h isomer of O4: An interim report
✍ Richard D. Harcourt 📂 Article 📅 1997 🏛 John Wiley and Sons 🌐 English ⚖ 179 KB 👁 2 views

Single-zeta and -electron double-zeta basis sets are used to examine some theories of the origin of the stability of the D isomer of O , using ab initio 2 h 4 Ž valence-bond procedures. With these basis sets, resonance between covalent-type i.e., . O и и O valence-bond structures does not lead to a

Model study of the impact of orbital cho
Model study of the impact of orbital choice on the accuracy of coupled-cluster energies. II. Valence-universal coupled-cluster method
✍ K. Jankowski; J. Gryniaków; K. Rubiniec 📂 Article 📅 1998 🏛 John Wiley and Sons 🌐 English ⚖ 229 KB 👁 2 views

The impact of the choice of molecular orbital sets on the results of the Ž valence-universal coupled cluster method involving up to three-body amplitudes VU-. CCSDT was studied for the H4 model. This model offers a straightforward way of representing all possible symmetry-adapted orbitals. Moreover,