Electron-molecule scattering at intermediate energy. Centrifugal-dominant channel decoupling and the INDOX polarized SCF model applied to N2 at 50 eV

Kunizo Onda; Donald G. Truhlar

doi:10.1063/1.438283

Electron-molecule scattering at intermediate energy. Centrifugal-dominant channel decoupling and the INDOX polarized SCF model applied to N₂ at 50 eV

Kunizo Onda
, Donald G. Truhlar

Chemistry (Twin Cities)

Research output: Contribution to journal › Article › peer-review

15 Scopus citations

Abstract

We have calculated cross sections for vibrationally-electronically elastic electron-N₂ scattering at 50 eV impact energy. The model interaction potential includes static, exchange, and polarization interactions calculated by the INDOX/1s method and the semiclassical exchange approximation with adiabatic polarization at large electron-molecule distances. The scattering is treated by converged rotational close coupling using a new channel decoupling scheme.

Original language	English (US)
Pages (from-to)	5097-5106
Number of pages	10
Journal	The Journal of chemical physics
Volume	71
Issue number	12
DOIs	https://doi.org/10.1063/1.438283
State	Published - 1979

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10.1063/1.438283

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title = "Electron-molecule scattering at intermediate energy. Centrifugal-dominant channel decoupling and the INDOX polarized SCF model applied to N2 at 50 eV",

abstract = "We have calculated cross sections for vibrationally-electronically elastic electron-N2 scattering at 50 eV impact energy. The model interaction potential includes static, exchange, and polarization interactions calculated by the INDOX/1s method and the semiclassical exchange approximation with adiabatic polarization at large electron-molecule distances. The scattering is treated by converged rotational close coupling using a new channel decoupling scheme.",

author = "Kunizo Onda and Truhlar, \{Donald G.\}",

year = "1979",

doi = "10.1063/1.438283",

language = "English (US)",

volume = "71",

pages = "5097--5106",

journal = "The Journal of chemical physics",

issn = "0021-9606",

publisher = "American Institute of Physics",

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T1 - Electron-molecule scattering at intermediate energy. Centrifugal-dominant channel decoupling and the INDOX polarized SCF model applied to N2 at 50 eV

AU - Onda, Kunizo

AU - Truhlar, Donald G.

PY - 1979

Y1 - 1979

N2 - We have calculated cross sections for vibrationally-electronically elastic electron-N2 scattering at 50 eV impact energy. The model interaction potential includes static, exchange, and polarization interactions calculated by the INDOX/1s method and the semiclassical exchange approximation with adiabatic polarization at large electron-molecule distances. The scattering is treated by converged rotational close coupling using a new channel decoupling scheme.

AB - We have calculated cross sections for vibrationally-electronically elastic electron-N2 scattering at 50 eV impact energy. The model interaction potential includes static, exchange, and polarization interactions calculated by the INDOX/1s method and the semiclassical exchange approximation with adiabatic polarization at large electron-molecule distances. The scattering is treated by converged rotational close coupling using a new channel decoupling scheme.

UR - https://www.scopus.com/pages/publications/36749117321

UR - https://www.scopus.com/pages/publications/36749117321#tab=citedBy

U2 - 10.1063/1.438283

DO - 10.1063/1.438283

M3 - Article

AN - SCOPUS:36749117321

SN - 0021-9606

VL - 71

SP - 5097

EP - 5106

JO - The Journal of chemical physics

JF - The Journal of chemical physics

IS - 12

ER -

Electron-molecule scattering at intermediate energy. Centrifugal-dominant channel decoupling and the INDOX polarized SCF model applied to N₂ at 50 eV

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