๐”– Bobbio Scriptorium
โœฆ   LIBER   โœฆ

The validity of Musher's model for the magnetic properties of aromatic molecules

โœ Scribed by P. Lazzeretti; R. Zanasi


Publisher
Elsevier Science
Year
1983
Tongue
English
Weight
274 KB
Volume
100
Category
Article
ISSN
0009-2614

No coin nor oath required. For personal study only.


๐Ÿ“œ SIMILAR VOLUMES


Gauge invariance and the magnetic proper
โœ R. McWeeny ๐Ÿ“‚ Article ๐Ÿ“… 1971 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 257 KB

Thoorics of mngnetic propcrtiee of motecules frequently employ the "gauge invariant" L1IO's first introduced by London. The bnsis for this choice of orbit& is reviewed, at the level OC approximate SCF theory, nnd the use of inappropriate gauge factors in previous work is pointed out. The invariance

Electric and magnetic properties of the
โœ P.W. Fowler; A.C. Legon; S.A. Peebles; E. Steiner ๐Ÿ“‚ Article ๐Ÿ“… 1995 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 435 KB

Self-consistent-field calculations on BrCl in a basis of 212 uncontracted Gaussian functions reproduce the measured dipole moment, nuclear quadrupole and spin-rotation coupling constants to within a few percent. The calculated mean polarisability of 36.8 au is 7% smaller than the average of the meas

Electric and magnetic properties of the
โœ P.W. Fowler; H.M. Kelly; A.J. Sadlej ๐Ÿ“‚ Article ๐Ÿ“… 1993 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 527 KB

The quadrupole moment, rotational g factor and magnet&ability tensors of PF, were calculated at the SCF/CHF level in a basis of Gaussian functions, giving values (in au) of &0.561; x1= -17.687; ,Y~ = -14.45 1; g,=O.O719; g, =0.0768 (with the origin at the centre of mass). Electron correlation (estim