Published August 1, 1989
| Version v1
Journal article
Minimum-variance approach to electron-scattering calculations: Elimination of anomalies and Monte Carlo implementation
Creators
- 1. Lawrence Livermore National Laboratory, P.O. Box 808, Livermore, California 94550
- 2. Department of Chemistry, The Ohio State University, Columbus, Ohio 43210 (USA)
Description
It is demonstrated, in calculations on one- and two-electron systems, that K-matrix (real-valued) boundary conditions in the trial wave function in the minimum-variance method can give anomalies at certain energies, while T-matrix (complex) boundary conditions do not. A Monte Carlo procedure is proposed for computing scattering amplitudes in a many-electron system that uses the minimum-variance approach to treat incident and target electrons on the same footing. Successful exploratory calculations on e/sup -/-H scattering in the radial limit suggest that this approach may provide a path to direct Monte Carlo scattering calculations on many-fermion systems
Additional details
Publishing Information
- Journal Title
- Physical Review, A
- Journal Volume
- 40
- Journal Issue
- 3
- Series
- Phys. Rev., A.
- Journal Page Range
- 1297-1301
- ISSN
- 0556-2791
- CODEN
- PLRAA
INIS
- Country of Publication
- United States
- Country of Input or Organization
- United States
- INIS RN
- 20081241
- Subject category
- S74: ATOMIC AND MOLECULAR PHYSICS;
- Descriptors DEI
- BOUNDARY CONDITIONS; ELECTRON-ATOM COLLISIONS; HYDROGEN; K MATRIX; MONTE CARLO METHOD; SCATTERING AMPLITUDES; WAVE FUNCTIONS
- Descriptors DEC
- AMPLITUDES; ATOM COLLISIONS; COLLISIONS; ELECTRON COLLISIONS; ELEMENTS; FUNCTIONS; MATRICES; NONMETALS