Model calculation of the spin density for trapped muonium in ionic solids
β Scribed by Yoshihiro Mizukami; George G. Hall
- Publisher
- Elsevier Science
- Year
- 1991
- Tongue
- English
- Weight
- 328 KB
- Volume
- 180
- Category
- Article
- ISSN
- 0009-2614
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β¦ Synopsis
A previously developed perturbation formula for calculating the spin density of trapped normal muonium in diamond is applied to the trapped muoniutn in the ionic solids of MgO, KC1 and KBr. To obtain an improved molecular electrostatic potential (MEP) inside the cubic lattice, we performed MO calculations using clusters of MgO, KC1 and KBrwith additional surrounding point charges. Calculated spin densities V'_values) in these potentials are compared with experimental results. We also report ab initio UHF MO calculations for these clusters with a trapped hydrogen atom at the centre of the clusters.
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