Iodine chemisorbed on Pt(111): A DFT study

Qun Liu; Ze Sheng Li

Iodine chemisorbed on Pt(111): A DFT study

Qun Liu^*, Ze Sheng Li

^*Corresponding author for this work

School of Chemistry and Chemical Engineering

Beijing Institute of Technology

Research output: Chapter in Book/Report/Conference proceeding › Conference contribution › peer-review

Abstract

The adsorption for I2 on the Pt(111) surface was investigated. The nudged elastic band method was applied to locate transition states. All results show that the dissociative adsorption on surface is more favored.

Original language	English
Title of host publication	Advanced Optoelectronics for Energy and Environment, AOEE 2013
Pages	ASa3A.03
Publication status	Published - 2013
Event	Advanced Optoelectronics for Energy and Environment, AOEE 2013 - Wuhan, China Duration: 25 May 2013 → 26 May 2013

Publication series

Name	Advanced Optoelectronics for Energy and Environment, AOEE 2013

Conference

Conference	Advanced Optoelectronics for Energy and Environment, AOEE 2013
Country/Territory	China
City	Wuhan
Period	25/05/13 → 26/05/13

UN SDGs

This output contributes to the following UN Sustainable Development Goals (SDGs)

Cite this

@inproceedings{2ceae3106e884da497baaa7ca5ec0eed,

title = "Iodine chemisorbed on Pt(111): A DFT study",

abstract = "The adsorption for I2 on the Pt(111) surface was investigated. The nudged elastic band method was applied to locate transition states. All results show that the dissociative adsorption on surface is more favored.",

author = "Qun Liu and Li, \{Ze Sheng\}",

year = "2013",

language = "English",

isbn = "9781557529763",

series = "Advanced Optoelectronics for Energy and Environment, AOEE 2013",

pages = "ASa3A.03",

booktitle = "Advanced Optoelectronics for Energy and Environment, AOEE 2013",

note = "Advanced Optoelectronics for Energy and Environment, AOEE 2013 ; Conference date: 25-05-2013 Through 26-05-2013",

}

TY - GEN

T1 - Iodine chemisorbed on Pt(111)

T2 - Advanced Optoelectronics for Energy and Environment, AOEE 2013

AU - Liu, Qun

AU - Li, Ze Sheng

PY - 2013

Y1 - 2013

N2 - The adsorption for I2 on the Pt(111) surface was investigated. The nudged elastic band method was applied to locate transition states. All results show that the dissociative adsorption on surface is more favored.

AB - The adsorption for I2 on the Pt(111) surface was investigated. The nudged elastic band method was applied to locate transition states. All results show that the dissociative adsorption on surface is more favored.

UR - http://www.scopus.com/pages/publications/84887740872

M3 - Conference contribution

AN - SCOPUS:84887740872

SN - 9781557529763

T3 - Advanced Optoelectronics for Energy and Environment, AOEE 2013

SP - ASa3A.03

BT - Advanced Optoelectronics for Energy and Environment, AOEE 2013

Y2 - 25 May 2013 through 26 May 2013

ER -

Iodine chemisorbed on Pt(111): A DFT study

Abstract

Publication series

Conference

UN SDGs

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