Effects of disorder on the eigenstates of rings of hydrogen atoms
β Scribed by R Day; J Ladik; F Martino
- Publisher
- Elsevier Science
- Year
- 1981
- Tongue
- English
- Weight
- 305 KB
- Volume
- 81
- Category
- Article
- ISSN
- 0009-2614
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β¦ Synopsis
Reported are self-consistent field calculations on disordered rings of hydrogen atoms and studies of the spatial nature of the resulting localized eigenstates as a function of degree of disorder. This model represents the simplest hamiltonian having realistic electron nucleus and electron-electron interactions, displaying both cellular and structural disorder.
π SIMILAR VOLUMES
G2 ab initio calculations on all ABX three-membered rings ## Ε½ . TMRs that can be derived from cyclopropane by systematic substitution of the -CH groups by -NH or -O groups have been performed. Our results show 2 that the decrease in the A-B bond length as the electronegativity of X increases is