Hylleraas hydride binding energy: diatomic electron affinities
Theoretical adiabatic electron affinities are often considered inaccurate because they are referenced to only a single value. Ground state electron affinities for all the main group elements and homonuclear diatomics were identified recently using the normalized binding energy of the hydrogen atom:...
| Үндсэн зохиолчид: | , , , , , , , , |
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| Бусад зохиолчид: | |
| Формат: | Өгүүллэг |
| Хэл сонгох: | English |
| Хэвлэсэн: |
Springer Berlin Heidelberg
2017
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| Онлайн хандалт: | http://hdl.handle.net/1721.1/107384 https://orcid.org/0000-0003-1117-7293 |
| Тойм: | Theoretical adiabatic electron affinities are often considered inaccurate because they are referenced to only a single value. Ground state electron affinities for all the main group elements and homonuclear diatomics were identified recently using the normalized binding energy of the hydrogen atom: [0.75420375(3)/2 = 0.37710187(1) eV]. Here we revisit experimental values and extend the identifications to diatomics in the G2-1 set. We assign new ground state electron affinities: (eV) Cl[subscript 2], 3.2(2); Br[subscript 2], 2.87(14); CH, 2.1(2); H[subscript 2], 0.6 ; NH, 1.1, SiH, 1.90. Anion Morse potentials are calculated for H[subscript 2] and N[subscript 2] from positive electron affinities and for hyperfine superoxide states for the first time. |
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