Abstract
Ionisation potentials of multiply charged ions have been calculated with the x alpha method using self-consistently determined parameters alpha . Self-consistent ab initio exchange parameters alpha have been determined for several ions. The ionisation energies have been determined by the transition state method of Slater and in a few cases by the method of Williams et al. (1975). The calculated ionisation energies are compared with Hartree-Fock and experimental data and found to be in agreement with them.
| Original language | English |
|---|---|
| Article number | 012 |
| Pages (from-to) | 3631-3637 |
| Number of pages | 7 |
| Journal | Journal of Physics B: Atomic and Molecular Physics |
| Volume | 20 |
| Issue number | 15 |
| DOIs | |
| Publication status | Published - 1987 |
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ASJC Scopus subject areas
- Atomic and Molecular Physics, and Optics
Cite this
X alpha method with theoretically determined parameter α- Exchange parameters α and ionisation energies of multiply charged ions. / Gaspar, R.; Nagy, A.
In: Journal of Physics B: Atomic and Molecular Physics, Vol. 20, No. 15, 012, 1987, p. 3631-3637.Research output: Article
}
TY - JOUR
T1 - X alpha method with theoretically determined parameter α- Exchange parameters α and ionisation energies of multiply charged ions
AU - Gaspar, R.
AU - Nagy, A.
PY - 1987
Y1 - 1987
N2 - Ionisation potentials of multiply charged ions have been calculated with the x alpha method using self-consistently determined parameters alpha . Self-consistent ab initio exchange parameters alpha have been determined for several ions. The ionisation energies have been determined by the transition state method of Slater and in a few cases by the method of Williams et al. (1975). The calculated ionisation energies are compared with Hartree-Fock and experimental data and found to be in agreement with them.
AB - Ionisation potentials of multiply charged ions have been calculated with the x alpha method using self-consistently determined parameters alpha . Self-consistent ab initio exchange parameters alpha have been determined for several ions. The ionisation energies have been determined by the transition state method of Slater and in a few cases by the method of Williams et al. (1975). The calculated ionisation energies are compared with Hartree-Fock and experimental data and found to be in agreement with them.
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UR - http://www.scopus.com/inward/citedby.url?scp=0343829006&partnerID=8YFLogxK
U2 - 10.1088/0022-3700/20/15/012
DO - 10.1088/0022-3700/20/15/012
M3 - Article
AN - SCOPUS:0343829006
VL - 20
SP - 3631
EP - 3637
JO - Journal of the Physics B: Atomic and Molecular Physics
JF - Journal of the Physics B: Atomic and Molecular Physics
SN - 0022-3700
IS - 15
M1 - 012
ER -