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author:

Li, Yulu (Li, Yulu.) [1] | Ding, Kaining (Ding, Kaining.) [2] (Scholars:丁开宁) | Cheng, Beisi (Cheng, Beisi.) [3] | Zhang, Yongfan (Zhang, Yongfan.) [4] (Scholars:章永凡) | Lu, Yunpeng (Lu, Yunpeng.) [5]

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Abstract:

First-principles density-functional calculation has been performed to investigate the synergistic effects of N and F doping on the photocatalytic properties of Zn2GeO4. Our results indicate that the presence of F facilitates the introduction of N by reducing the formation energy significantly. As N and F is codoped into Zn2GeO4, the mobility of the charge carriers is more rapid due to the dispersive levels above the valence band. And with the narrowed band gap the optical absorption spectrum red-shifts into the ideal visible-light region. Thus, we propose that the codoping of N and F can be a promising strategy to promote the photocatalytic performances of Zn2GeO4 under visible light.

Keyword:

Community:

  • [ 1 ] [Li, Yulu]Fuzhou Univ, Coll Chem, Res Inst Photocatalysis, State Key Lab Photocatalysis Energy & Environm, Fuzhou 350108, Fujian, Peoples R China
  • [ 2 ] [Ding, Kaining]Fuzhou Univ, Coll Chem, Res Inst Photocatalysis, State Key Lab Photocatalysis Energy & Environm, Fuzhou 350108, Fujian, Peoples R China
  • [ 3 ] [Cheng, Beisi]Fuzhou Univ, Coll Chem, Res Inst Photocatalysis, State Key Lab Photocatalysis Energy & Environm, Fuzhou 350108, Fujian, Peoples R China
  • [ 4 ] [Zhang, Yongfan]Fuzhou Univ, Coll Chem, Res Inst Photocatalysis, State Key Lab Photocatalysis Energy & Environm, Fuzhou 350108, Fujian, Peoples R China
  • [ 5 ] [Zhang, Yongfan]Chinese Acad Sci, Key Lab Optoelect Mat Chem & Phys, Fuzhou 350002, Fujian, Peoples R China
  • [ 6 ] [Lu, Yunpeng]Nanyang Technol Univ, Sch Phys & Math Sci, Div Chem & Biol Chem, Singapore 637371, Singapore

Reprint 's Address:

  • 丁开宁

    [Ding, Kaining]Fuzhou Univ, Coll Chem, Res Inst Photocatalysis, State Key Lab Photocatalysis Energy & Environm, Fuzhou 350108, Fujian, Peoples R China

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Source :

PHYSICAL CHEMISTRY CHEMICAL PHYSICS

ISSN: 1463-9076

Year: 2015

Issue: 8

Volume: 17

Page: 5613-5623

4 . 4 4 9

JCR@2015

2 . 9 0 0

JCR@2023

ESI Discipline: CHEMISTRY;

ESI HC Threshold:265

JCR Journal Grade:1

CAS Journal Grade:2

Cited Count:

WoS CC Cited Count:

SCOPUS Cited Count:

ESI Highly Cited Papers on the List: 0 Unfold All

WanFang Cited Count:

Chinese Cited Count:

30 Days PV: 0

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