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IONIZATION ENERGIES OF THE N 2 , CO , CO 2 , N 20 , C 2 H 2 AND SiH 4 MOLECULES CALCULATED BY UNIVERSAL MODEL POTENTIAL
| Content Provider | Semantic Scholar |
|---|---|
| Abstract | The atomic universal potential constructed by G)Ÿ193 [2] was used in the scattered-wave (SW) method [3]. The way of application of the universal potential to generate the molecular potential is presented and discussed here. (We also refer to our previous paper [1].) In the scattered-wave formalism the molecular space is partitioned into three types of regions: atomie, interatomic and extramolecular. The muffintin approximation is applied in our modified SW method. The molecular potential is considered to be spherical in the atomic and in the extramoleeular regions and constant in the interatomic region. The modified one-electron molecular Xa ecluation [1] is [ 'Ÿ237 + V(1)]u;(1) -~ ei ui(1) . (1) |
| File Format | PDF HTM / HTML |
| Alternate Webpage(s) | https://page-one.springer.com/pdf/preview/10.1007/BF03157899 |
| Language | English |
| Access Restriction | Open |
| Content Type | Text |
| Resource Type | Article |
