𝔖 Bobbio Scriptorium
✦   LIBER   ✦

An Efficient Fragment-Based Approach for Predicting the Ground-State Energies and Structures of Large Molecules

✍ Scribed by Li, Shuhua; Li, Wei; Fang, Tao


Book ID
126154984
Publisher
American Chemical Society
Year
2005
Tongue
English
Weight
570 KB
Volume
127
Category
Article
ISSN
0002-7863

No coin nor oath required. For personal study only.


πŸ“œ SIMILAR VOLUMES


Localized electron pair theory for the c
✍ J.M. Cullen πŸ“‚ Article πŸ“… 1992 πŸ› John Wiley and Sons 🌐 English βš– 743 KB

The quantum mechanical energy is examined in which groups of one, two, three, and four localized electron pairs found within a molecule are separately computed. From these results, the interaction energies of the electron pairs taken one, two, three, and four at a time form the terms of a convergent