| Evaluation of Orbital- and Ground State Energies of Some Open- and Closed-Shell Atoms over Integer and Noninteger Slater Type Orbitals |
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| 引用本文： | YAKAR, Yusuf. Evaluation of Orbital- and Ground State Energies of Some Open- and Closed-Shell Atoms over Integer and Noninteger Slater Type Orbitals[J]. 中国化学, 2007, 25(1): 25-31. DOI: 10.1002/cjoc.200790012 |
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| 作者姓名： | YAKAR Yusuf |
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| 作者单位： | Department of Physics, Faculty of Arts and Science, Aksaray University, Aksaray, Turkey |
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| 摘 要： |
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| 关 键 词： | 斯莱特型轨道 整数型轨道 非整数型轨道 基态能 开壳层原子 闭壳层原子 |
| 修稿时间： | 2006-02-142006-09-15 |
Evaluation of Orbital- and Ground State Energies of Some Open- and Closed-Shell Atoms over Integer and Noninteger Slater Type Orbitals |
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| YAKAR, Yusuf. Evaluation of Orbital- and Ground State Energies of Some Open- and Closed-Shell Atoms over Integer and Noninteger Slater Type Orbitals[J]. Chinese Journal of Chemistry, 2007, 25(1): 25-31. DOI: 10.1002/cjoc.200790012 |
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| Authors: | YAKAR Yusuf |
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| Affiliation: | Department of Physics, Faculty of Arts and Science, Aksaray University, Aksaray, Turkey |
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| Abstract: | Ab initio calculations of the orbital and the ground state energies of some open- and closed-shell atoms over Slater type orbitals with quantum numbers integer and Slater type orbitals with quantum numbers noninteger have been performed. In order to increase the efficiency of these calculations the atomic two-electron integrals were expressed in terms of incomplete beta function. Results were observed to be in good agreement with the literature. |
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| Keywords: | integer and noninteger Slater type orbital ground state energy of open- and closed-shell atoms incomplete beta function. |
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