| Journal: | Quimica nova |
| Database: | PERIÓDICA |
| System number: | 000198257 |
| ISSN: | 0100-4042 |
| Authors: | Rino, Jose Pedro1 Studart, Nelson |
| Institutions: | 1Universidade Federal de Sao Carlos, Departamento de Fisica, Sao Carlos, Sao Paulo. Brasil |
| Year: | 2001 |
| Season: | Nov-Dic |
| Volumen: | 24 |
| Number: | 6 |
| Pages: | 838-845 |
| Country: | Brasil |
| Language: | Portugués |
| Document type: | Revisión bibliográfica |
| Approach: | Teórico, descriptivo |
| English abstract | The Vashishta-Rahman effective interaction potential, based on the Pauling's concept of "ionic radii", has been successfully employed to investigate structural and dynamical properties of different classes of material. By celebrating Pauling's birth centenary, we review the building up of the Vashishta-Rahman potential and we present molecular-dynamics simulation results for structure and dynamics of superionic materials, chalcogenide glasses and metallic oxides |
| Disciplines: | Ingeniería, Física y astronomía |
| Keyword: | Ingeniería de materiales, Física atómica y molecular, Materiales, Potencial Vashishta-Rahman, Potencial, Potencial de interacción, Dinámica molecular, Materiales superiónicos, Pauling, Simulación computacional, Simulación |
| Keyword: | Engineering, Physics and astronomy, Materials engineering, Atomic and molecular physics, Materials, Vasihsta-Rahman potential, Potential, Interaction potential, Molecular dynamics, Superionic material, Pauling, Computational simulation, Simulation |
| Full text: | Texto completo (Ver HTML) |
