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Can I read Abinttio calculation of the ionization potentials and hyperfine splitting constants of the radical anions FClXXX and Cl2XXX on EtoBox?
Abinttio calculation of the ionization potentials and hyperfine splitting constants of the radical anions FClXXX and Cl2XXX by Minh Tho Nguyen; Tae-Kyu Ha is a Physics and Astronomy article available to read on EtoBox.
What is Abinttio calculation of the ionization potentials and hyperfine splitting constants of the radical anions FClXXX and Cl2XXX about?
Employing a CI wavefunction with a DZ + (2d) basis set, the isotropic hyperflne splitting constants for the F and Cl nuclei in the gas-phase radical anions FCl-and Cl, were evaluated. The ionization potentials are calculated as 2.1 O-2.27 eV for FCl-and 2.22-2.28 eV for Cl;, the latter comparing well with the experimental value of 2.32-2.38 eV. ' To whom correspondence should be addressed.
Who reads Abinttio calculation of the ionization potentials and hyperfine splitting constants of the radical anions FClXXX and Cl2XXX?
It is typically read by researchers, students, and practitioners in Physics and Astronomy.
- Author
- Minh Tho Nguyen; Tae-Kyu Ha
- Publisher
- Elsevier Science; Elsevier ; Elsevier BV (ISSN 0009-2614)
- Published
- 1987
- Language
- EN
- Field
- Physics and Astronomy (Physical Sciences)