Gauging away the electron–electron interaction by the local phase of complex wave functions in two-electron systems
この論文をさがす
抄録
The electron-electron interaction is eliminated in the expectation values of the electronic Hamiltonian for two-electron systems. The part of the Hamiltonian referring to the repulsive interaction is gauged away by the local phase of the complex wave functions, much like a gauge <br />eld transformation, thereby leading to a one-electron Hamiltonian. Despite the appearance of complex wave functions, the expectation values of the total momentum operator vanish and Lowdin's criterion holds for the stationary states.
収録刊行物
-
- Journal of Mathematical Chemistry
-
Journal of Mathematical Chemistry 55 (1), 98-104, 2017-01
Springer
- Tweet
詳細情報 詳細情報について
-
- CRID
- 1050001201679370624
-
- NII論文ID
- 120006342442
-
- NII書誌ID
- AA10704322
-
- ISSN
- 15728897
- 02599791
-
- HANDLE
- 10258/00009462
-
- 本文言語コード
- en
-
- 資料種別
- journal article
-
- データソース種別
-
- IRDB
- CiNii Articles