𝔖 Bobbio Scriptorium
✦   LIBER   ✦

The relation of harmonic force constant and charge density in bonding region for diatomic molecules

✍ Scribed by W.S. Ptak; J. Giemza; K. Tkacz


Publisher
Elsevier Science
Year
1986
Tongue
English
Weight
181 KB
Volume
142
Category
Article
ISSN
0022-2860

No coin nor oath required. For personal study only.


📜 SIMILAR VOLUMES


Prediction of spectroscopic constants fo
✍ Chantal T. Falzon; Delano P. Chong; Feng Wang 📂 Article 📅 2005 🏛 John Wiley and Sons 🌐 English ⚖ 544 KB

## Abstract Spectroscopic constants of the ground and next seven low‐lying excited states of diatomic molecules CO, N~2~, P~2~, and ScF were computed using the density functional theory SAOP/ATZP model, in conjunction with time‐dependent density functional theory (TD‐DFT) and a recently developed S

An ab initio study of the relationship b
✍ Charles W. Bock; Mendel Trachtman; Philip George 📂 Article 📅 1982 🏛 John Wiley and Sons 🌐 English ⚖ 801 KB

## Abstract The OH bond length and the quadratic, cubic, and quartic stretching force constants, calculated __ab initio__ using the unscaled 4‐31G basis set with full geometry optimization, are reported for 30 planar conformers of ten molecules contaning either the COH, NOH, or OOH group. The d