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...

Full description

Saved in:
Bibliographic Details
Main Authors: Luo, Bin, Ye, Jun, Guan, Chengbo, Zhao, Yang
Other Authors: School of Materials Science & Engineering
Format: Article
Language:English
Published: 2010
Subjects:
Online Access:https://hdl.handle.net/10356/91334
http://hdl.handle.net/10220/6304
Tags: Add Tag
No Tags, Be the first to tag this record!
Institution: Nanyang Technological University
Language: English
id sg-ntu-dr.10356-91334
record_format dspace
spelling 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
institution Nanyang Technological University
building NTU Library
continent Asia
country Singapore
Singapore
content_provider NTU Library
collection DR-NTU
language English
topic DRNTU::Science::Physics::Atomic physics::Properties of matter and antimatter
spellingShingle 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