Vertical electron detachment energies of F y and OH y have presented difficulties for perturbative electron propagator methods. A recently derived, nondiagonal, renormalized approximation and two additional improvements are studied here. These improvements are replacement of the HartreeαFock referen
β¦ LIBER β¦
Orbital and shakeup operator renormalizations in electron propagator theory
β Scribed by Ortiz, J. V.
- Book ID
- 115442882
- Publisher
- American Institute of Physics
- Year
- 1998
- Tongue
- English
- Weight
- 350 KB
- Volume
- 109
- Category
- Article
- ISSN
- 0021-9606
- DOI
- 10.1063/1.477196
No coin nor oath required. For personal study only.
π SIMILAR VOLUMES
Approximate Brueckner orbitals and shake
β
J. V. Ortiz
π
Article
π
1998
π
John Wiley and Sons
π
English
β 273 KB
Second-order shakeup terms in electron p
β
J. V. Ortiz
π
Article
π
1998
π
John Wiley and Sons
π
English
β 155 KB
π 1 views
A new approximation of the electron propagator includes second-order terms in the superoperator Hamiltonian matrix that are not present in the nondiagonal, Ε½ . Ε½ . renormalized method NR2 of J. Chem. Phys. 108, 1008 1998 . These terms are not difficult to calculate and resemble expressions obtained
One-electron density matrices and energy
β
Cioslowski, Jerzy; Ortiz, J. V.
π
Article
π
1992
π
American Institute of Physics
π
English
β 801 KB
Operator vertices and propagators in dua
β
D. I. Olive
π
Article
π
1971
π
Springer-Verlag
β 555 KB
Dynamics of electron wave propagation in
β
Zhao, L. B.; Delos, J. B.
π
Article
π
2010
π
The American Physical Society
π
English
β 879 KB
Electron propagator theory: an approach
β
Joseph Vincent Ortiz
π
Article
π
2012
π
Wiley (John Wiley & Sons)
π
English
β 256 KB