The ab initio perturbed ion method has been applied to CeOz in order to characterize the geometric, mechanical, thermodynamic and electronic properties of the ground state of this system. The lattice parameter is found to be 535.3 pm, the bulk modulus is 5977 MPa, the lattice energy is -98 17.3 kJ m
An Ab initio study of the tetrahedral NH4− ion
✍ Scribed by H. Cardy; C. Larrieu; A. Dargelos
- Publisher
- Elsevier Science
- Year
- 1986
- Tongue
- English
- Weight
- 475 KB
- Volume
- 131
- Category
- Article
- ISSN
- 0009-2614
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