| Journal: | Revista mexicana de física |
| Database: | PERIÓDICA |
| System number: | 000350589 |
| ISSN: | 0035-001X |
| Authors: | Marquina, V1 Gómez, R.W1 |
| Institutions: | 1Universidad Nacional Autónoma de México, Facultad de Ciencias, México, Distrito Federal. México |
| Year: | 2012 |
| Season: | Feb |
| Volumen: | 58 |
| Number: | 1 |
| Pages: | 13-18 |
| Country: | México |
| Language: | Inglés |
| Document type: | Artículo |
| Approach: | Analítico, teórico |
| English abstract | A simple algorithm and a computational program to numerically compute the electric field gradient and the concomitant quadrupolar nuclear splitting is developed for an arbitrary ionic crystal. The calculations are performed using a point charge model. The program provides three different ways for the data input: by Bravais lattices, by lattice parameters, or by introducing any spatial structure. The program calculates the components of the electric field gradient, the asymmetry parameter and the quadrupolar splitting for a given number of nearest neighbors with respect to the nuclear charge as origin. In addition, the program allows the use of different Sternheimer antishielding factors |
| Disciplines: | Física y astronomía |
| Keyword: | Física de materia condensada, Gradiente de campo eléctrico, Cuadrupolo, Espectroscopía Mossbauer, Algoritmos, Parámetro de asimetría, Cristales iónicos |
| Keyword: | Physics and astronomy, Condensed matter physics, Electric field gradient, Quadrupole, Mossbauer spectroscopy, Algorithms, Asymmetry parameter, Ionic crystals |
| Full text: | Texto completo (Ver PDF) |
