A tensor product decomposition of the many-electron Hamiltonian
A new direct full variational approach is described. The approach exploits a tensor (Kronecker) product construction of the many-electron Hamiltonian and has a number of computational advantages. Explicit assembly and storage of the Hamiltonian matrix is avoided by using the Kronecker product struct...
| Main Author: | |
|---|---|
| Other Authors: | |
| Format: | Others |
| Language: | en_US |
| Published: |
Virginia Polytechnic Institute and State University
2015
|
| Subjects: | |
| Online Access: | http://hdl.handle.net/10919/54413 |