Published October 13, 2021 | Version v1
Dataset Open

Integral and differential elastic cross sections for electron scattering from water for 0.1-15 eV

  • 1. The Open University

Description

Elastic integral and differential cross sections (DCS) for electron scattering from H2O calculated with the R-matrix method within the fixed-nuclei approximation. Details of the calculations can be found in Evaluation of Recommended Cross Sections for the simulation of Electron Tracks in Water, García-Abenza et al., Atoms, submitted. The models used for the calculations were taken from Gorfinkiel et al. J. Phys. B 35 (2002) 543, doi:10.1088/0953-4075/35/3/309 and Faure et al. J. Phys. 37 (2004) 801, doi:10.1088/0953-4075/37/4/007.

All energies are in eV, angles in degrees and cross sections in Angstrom**2. The dcs_*** files contain DCS for the energy indicated by the file name for angles between 0 and 180; the integral_cross_section file contains the integral cross section for the energy range indicated by the zip file.

These zip files contain the following:

  • dcs_0-7eV.zip:  data DCS between 0.01 and 6.97 eV calculated using the UKRmol suite and POLYDCS from K-matrices
  • dcs_7-15eV.zip: DCS between 7.01 and 15.0 eV calculated using the UKRmol suite and POLYDCS from T-matrices
  • dcs_noborn_0-7eV.zip:  data DCS between 0.01 and 6.97 eV calculated using the UKRmol suite and POLYDCS from K-matrices treating the molecule as non-polar
  • dcs_7-15eV.zip: DCS between 7.01 and 15.0 eV calculated using the UKRmol suite and DCS from T-matrices treating the molecule as non-polar.

Files

dcs_0-7eV.zip

Files (1.1 MB)

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