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author:

Peng, Qiong (Peng, Qiong.) [1] | Xiong, Rui (Xiong, Rui.) [2] | Sa, Baisheng (Sa, Baisheng.) [3] (Scholars:萨百晟) | Zhou, Jian (Zhou, Jian.) [4] | Wen, Cuilian (Wen, Cuilian.) [5] (Scholars:温翠莲) | Wu, Bo (Wu, Bo.) [6] (Scholars:吴波) | Anpo, Masakazu (Anpo, Masakazu.) [7] | Sun, Zhimei (Sun, Zhimei.) [8]

Indexed by:

EI Scopus SCIE

Abstract:

Strongly suppressed recombination of electron-hole pairs, unexpectedly high carrier mobility, and anomalous optical response were found in an atomically thin indium selenide (InSe) photocatalyst. In this study, we unraveled the photocatalytic potential of two-dimensional (2D) InSe-family group-III monochalcogenide MX (M = Ga and In and X = S, Se, and Te) monolayers as water splitting hydrogen production photocatalysts on the basis of density functional theory. Our results not only highlight the high electron mobility and small exciton binding energy of 2D InSe, but also demonstrate the energy evolution of the adsorption and decomposition of water molecules as well as the hydrogen production process at the 2D InSe surface. The excellent stability of the MX monolayers was confirmed using lattice dynamical calculations as well as the ab initio molecular dynamics simulations in vacuum and aqueous environments. Moreover, distinguished optical absorption performance of the MX monolayers resulted in effective sunlight energy conversion as high as 1.20%, 6.40%, and 3.22% for the InSe, InTe, and GaTe monolayers, respectively.

Keyword:

Community:

  • [ 1 ] [Peng, Qiong]Fuzhou Univ, Multiscale Computat Mat Facil, Coll Mat Sci & Engn, Fuzhou 350100, Peoples R China
  • [ 2 ] [Xiong, Rui]Fuzhou Univ, Multiscale Computat Mat Facil, Coll Mat Sci & Engn, Fuzhou 350100, Peoples R China
  • [ 3 ] [Sa, Baisheng]Fuzhou Univ, Multiscale Computat Mat Facil, Coll Mat Sci & Engn, Fuzhou 350100, Peoples R China
  • [ 4 ] [Wen, Cuilian]Fuzhou Univ, Multiscale Computat Mat Facil, Coll Mat Sci & Engn, Fuzhou 350100, Peoples R China
  • [ 5 ] [Wu, Bo]Fuzhou Univ, Multiscale Computat Mat Facil, Coll Mat Sci & Engn, Fuzhou 350100, Peoples R China
  • [ 6 ] [Peng, Qiong]Fujian Prov Univ, Key Lab Ecomat Adv Technol, Fuzhou Univ, Fuzhou 350100, Peoples R China
  • [ 7 ] [Xiong, Rui]Fujian Prov Univ, Key Lab Ecomat Adv Technol, Fuzhou Univ, Fuzhou 350100, Peoples R China
  • [ 8 ] [Sa, Baisheng]Fujian Prov Univ, Key Lab Ecomat Adv Technol, Fuzhou Univ, Fuzhou 350100, Peoples R China
  • [ 9 ] [Wen, Cuilian]Fujian Prov Univ, Key Lab Ecomat Adv Technol, Fuzhou Univ, Fuzhou 350100, Peoples R China
  • [ 10 ] [Wu, Bo]Fujian Prov Univ, Key Lab Ecomat Adv Technol, Fuzhou Univ, Fuzhou 350100, Peoples R China
  • [ 11 ] [Sa, Baisheng]Beihang Univ, Sch Mat Sci & Engn, Beijing 100191, Peoples R China
  • [ 12 ] [Zhou, Jian]Beihang Univ, Sch Mat Sci & Engn, Beijing 100191, Peoples R China
  • [ 13 ] [Sun, Zhimei]Beihang Univ, Sch Mat Sci & Engn, Beijing 100191, Peoples R China
  • [ 14 ] [Sa, Baisheng]Beihang Univ, Ctr Integrated Computat Mat Engn, Int Res Inst Multidisciplinary Sci, Beijing 100191, Peoples R China
  • [ 15 ] [Zhou, Jian]Beihang Univ, Ctr Integrated Computat Mat Engn, Int Res Inst Multidisciplinary Sci, Beijing 100191, Peoples R China
  • [ 16 ] [Sun, Zhimei]Beihang Univ, Ctr Integrated Computat Mat Engn, Int Res Inst Multidisciplinary Sci, Beijing 100191, Peoples R China
  • [ 17 ] [Anpo, Masakazu]Osaka Prefecture Univ, Grad Sch Engn, Dept Appl Chem, Sakai, Osaka, Japan

Reprint 's Address:

  • 萨百晟 吴波

    [Sa, Baisheng]Fuzhou Univ, Multiscale Computat Mat Facil, Coll Mat Sci & Engn, Fuzhou 350100, Peoples R China;;[Wu, Bo]Fuzhou Univ, Multiscale Computat Mat Facil, Coll Mat Sci & Engn, Fuzhou 350100, Peoples R China;;[Sa, Baisheng]Fujian Prov Univ, Key Lab Ecomat Adv Technol, Fuzhou Univ, Fuzhou 350100, Peoples R China;;[Wu, Bo]Fujian Prov Univ, Key Lab Ecomat Adv Technol, Fuzhou Univ, Fuzhou 350100, Peoples R China;;[Sa, Baisheng]Beihang Univ, Sch Mat Sci & Engn, Beijing 100191, Peoples R China;;[Sun, Zhimei]Beihang Univ, Sch Mat Sci & Engn, Beijing 100191, Peoples R China;;[Sa, Baisheng]Beihang Univ, Ctr Integrated Computat Mat Engn, Int Res Inst Multidisciplinary Sci, Beijing 100191, Peoples R China;;[Sun, Zhimei]Beihang Univ, Ctr Integrated Computat Mat Engn, Int Res Inst Multidisciplinary Sci, Beijing 100191, Peoples R China

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Source :

CATALYSIS SCIENCE & TECHNOLOGY

ISSN: 2044-4753

Year: 2017

Issue: 13

Volume: 7

Page: 2744-2752

5 . 3 6 5

JCR@2017

4 . 4 0 0

JCR@2023

ESI Discipline: CHEMISTRY;

ESI HC Threshold:226

JCR Journal Grade:1

CAS Journal Grade:3

Cited Count:

WoS CC Cited Count: 127

SCOPUS Cited Count: 127

ESI Highly Cited Papers on the List: 0 Unfold All

WanFang Cited Count:

Chinese Cited Count:

30 Days PV: 4

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