𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Quantum-mechanical treatment of molecules. I. Calculations of the potential energy curves and molecular constants of the ground and ionized states of N2

✍ Scribed by R. C. Sahni; B. C. Sawhney

Publisher
John Wiley and Sons
Year
1967
Tongue
English
Weight
867 KB
Volume
1
Category
Article
ISSN
0020-7608

No coin nor oath required. For personal study only.

πŸ“œ SIMILAR VOLUMES

Numerical MC SCF and CI calculations of
Numerical MC SCF and CI calculations of the ground-state potential energy curve of N2
✍ Walter C. Ermler; Chen-Wen Huang πŸ“‚ Article πŸ“… 1985 πŸ› Elsevier Science 🌐 English βš– 111 KB

The numeri~l procedure or McCullough is used in calculaGtns or Harrrtzz-Fock nnd hlC SCF waveruntxions for ground spate of N2\_ The la~cr are derived using the complete set of 1s spin and symmc~ry adapted configurnlions in the space or MOs lhnt arise from 7p ntomic orbilals. An incrust in disuxialio

The Molecular Constants and Potential En
The Molecular Constants and Potential Energy Curve of the Ground StateX1Ξ£+in KLi
✍ V. Bednarska; I. Jackowska; W. JastrzΔ™bski; P. Kowalczyk πŸ“‚ Article πŸ“… 1998 πŸ› Elsevier Science 🌐 English βš– 119 KB

The ground state X 1 S / of the diatomic molecule KLi has been studied by analyzing spectra of the B 1 P-X 1 S / system, simplified by polarization labeling. Rotational and vibrational constants are reported for the X 1 S / state covering about 45% of its potential well depth and the potential curve

Potential energy curves for the ground a
Potential energy curves for the ground and excited states of alh+
✍ Martyn F. Guest; David M. Hirst πŸ“‚ Article πŸ“… 1981 πŸ› Elsevier Science 🌐 English βš– 394 KB

PotentA energy curves for low-lying doublet states of AlH+ dlssociatmg to Ai+ + H, Al+(3P) f H, Ai+ f Hand Al(\*P) + H+ have been detemuned by ab mitt0 confiiatton interaction calculations. Tbe B' \*E+ state is predicted to be bound with a bond length of 2.06 A. Shallow muum are found for 4 \*Z+ and