Ab initio treatment of ion-water molecule collisions with a three-center pseudo potential
Entidad
UAM. Departamento de QuímicaEditor
IOP Publishing Ltd.Fecha de edición
2012-12-11Cita
10.1088/1742-6596/388/10/102034
Journal of Physics: Conference Series 388 (2012): 102034
ISSN
1742-6588 (print); 1742-6596 (online)DOI
10.1088/1742-6596/388/10/102034Versión del editor
http://dx.doi.org/10.1088/1742-6596/388/10/102034Materias
QuímicaDerechos
© Published under licence by IOP Publishing Ltd.Resumen
We calculate electron capture cross sections in collisions of protons with water molecules, using two simple ab initio approaches. The formalism involves the calculation of one-electron scattering wave functions and the use of three-center pseudo potential to represent the electron H2O+ interaction. Several methods to obtain many-electron cross sections are considered
Lista de ficheros
Google Scholar:Martínez, P.
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Errea, L. F.
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Méndez Ambrosio, Luis
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Rabadán Romero, Ismanuel
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