Validity of time-dependent trial states for the Holstein Polaron
Validity of three time-dependent trial states for the Holstein Hamiltonian, namely, the D2, Merrifield and D Ansatze has been examined in detail with regards to their deviations from the exact solution to the time-dependent Schrodinger equation. Linear absorption spectra are also calculated as an a...
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sg-ntu-dr.10356-913342023-07-14T15:52:49Z Validity of time-dependent trial states for the Holstein Polaron Luo, Bin Ye, Jun Guan, Chengbo Zhao, Yang School of Materials Science & Engineering DRNTU::Science::Physics::Atomic physics::Properties of matter and antimatter Validity of three time-dependent trial states for the Holstein Hamiltonian, namely, the D2, Merrifield and D Ansatze has been examined in detail with regards to their deviations from the exact solution to the time-dependent Schrodinger equation. Linear absorption spectra are also calculated as an additional indicator of the Ansatz validity. It is found that the D Ansatz is the most accurate trial state of the three, and all Ansatze fail to provide an adequate description of system dynamics in the weak-coupling regime. Accepted version 2010-07-23T03:50:50Z 2019-12-06T18:03:50Z 2010-07-23T03:50:50Z 2019-12-06T18:03:50Z 2010 2010 Journal Article Luo, B., Ye, J., Guan, C., & Zhao, Y. (2010). Validity of time-dependent trial states for the Holstein Polaron. Physical Chemistry Chemical Physics. 1463-9076 https://hdl.handle.net/10356/91334 http://hdl.handle.net/10220/6304 153756 en Physical chemistry chemical physics : PCCP 22 p. application/pdf |
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DRNTU::Science::Physics::Atomic physics::Properties of matter and antimatter |
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DRNTU::Science::Physics::Atomic physics::Properties of matter and antimatter Luo, Bin Ye, Jun Guan, Chengbo Zhao, Yang Validity of time-dependent trial states for the Holstein Polaron |
| description |
Validity of three time-dependent trial states for the Holstein Hamiltonian, namely, the D2, Merrifield and D Ansatze has been examined in detail with regards to their deviations from the exact solution to the time-dependent Schrodinger equation. Linear absorption spectra are also calculated as an additional indicator of the Ansatz validity. It is found that the D Ansatz is the most accurate trial state of the three, and all Ansatze fail to provide an adequate description of system dynamics in the weak-coupling regime. |
| author2 |
School of Materials Science & Engineering |
| author_facet |
School of Materials Science & Engineering Luo, Bin Ye, Jun Guan, Chengbo Zhao, Yang |
| format |
Article |
| author |
Luo, Bin Ye, Jun Guan, Chengbo Zhao, Yang |
| author_sort |
Luo, Bin |
| title |
Validity of time-dependent trial states for the Holstein Polaron |
| title_short |
Validity of time-dependent trial states for the Holstein Polaron |
| title_full |
Validity of time-dependent trial states for the Holstein Polaron |
| title_fullStr |
Validity of time-dependent trial states for the Holstein Polaron |
| title_full_unstemmed |
Validity of time-dependent trial states for the Holstein Polaron |
| title_sort |
validity of time-dependent trial states for the holstein polaron |
| publishDate |
2010 |
| url |
https://hdl.handle.net/10356/91334 http://hdl.handle.net/10220/6304 |
| _version_ |
1772827784327987200 |