Collect. Czech. Chem. Commun.
1998, 63, 1264-1284
https://doi.org/10.1135/cccc19981264
Evaluation of Molecular Integrals in a Mixed Gaussian and Plane-Wave Basis by Means of the Faddeeva Function and Its Derivatives
Petr Čársky and Tomáš Reschel
J. Heyrovský Institute of Physical Chemistry, Academy of Sciences of the Czech Republic, 182 23 Prague 8, Czech Republic
Crossref Cited-by Linking
- Čársky Petr, Čurík Roman: Efficient evaluation of exchange integrals by means of Fourier transform of the 1/r operator and its numerical quadrature. Theor Chem Acc 2014, 133. <https://doi.org/10.1007/s00214-014-1466-9>
- Čársky Petr: Towards efficientab initiocalculations of electron scattering by polyatomic molecules: II. Efficient evaluation of exchange integrals. J. Phys. B: At. Mol. Opt. Phys. 2010, 43, 175204. <https://doi.org/10.1088/0953-4075/43/17/175204>
- Cur k R, C rsky P: Vibrationally inelastic electron scattering on polyatomic molecules by the discrete momentum representation (DMR) method. J. Phys. B: At. Mol. Opt. Phys. 2003, 36, 2165. <https://doi.org/10.1088/0953-4075/36/11/303>
- Polášek Martin, Čársky Petr: Efficient Evaluation of the Matrix Elements of the Coulomb Potential between Plane Waves and Gaussians. Journal of Computational Physics 2002, 181, 1. <https://doi.org/10.1006/jcph.2002.7124>
- Polášek Martin, Juřek Michael, Ingr Marek, Čársky Petr, Horáček Jiří: Discrete momentum representation of the Lippmann-Schwinger equation and its application to electron-molecule scattering. Phys. Rev. A 2000, 61. <https://doi.org/10.1103/PhysRevA.61.032701>
