ELECTRONIC PROPERTIES OF ATOMS AND COVALENT RADIUS DETERMINED BY MEANS OF AN EXCHANGE POTENTIAL NEW MODEL CONTAINING SELF INTERACTION AND GRADIENT CORRECTIONS
Within the Density Functional Theory a new model of exchange potential containing corrective terms for self interaction and long range behavior is proposed . This potential model contains three constants: alpha , beta and gamma. The first two are determined through experimental data while the third...
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| Autores principales: | , |
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| Lenguaje: | English |
| Publicado: |
Sociedad Chilena de Química
2003
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| Acceso en línea: | http://www.scielo.cl/scielo.php?script=sci_arttext&pid=S0717-97072003000400006 |
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