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author:

Luo, Luteng (Luo, Luteng.) [1] | Cui, Weiting (Cui, Weiting.) [2] | Xue, Hang (Xue, Hang.) [3] | Ke, Sunzai (Ke, Sunzai.) [4] | Yang, Xuhui (Yang, Xuhui.) [5] | Yang, Min-Quan (Yang, Min-Quan.) [6] | Qian, Qingrong (Qian, Qingrong.) [7]

Indexed by:

EI SCIE

Abstract:

Black phosphorene (BP) is a metal-free two-dimensional photocatalyst with potential for visible-light-driven photocatalytic H-2 evolution. However, its inert basal plane toward the HER hinders its practical application. To overcome this problem, we design a novel nonprecious metal-nonmetal co-doping method of BP to activate its inert basal plane and improve photocatalytic HER performance. Through density functional theory (DFT) calculations, we systematically investigate the photocatalytic performance of nonprecious metal and nonmetal co-doped BPs. Our results show that V-N co-doped BP exhibits excellent thermodynamic stability, suitable band structure, improved carrier separation, superior adsorption and dissociation energies and enhanced visible-light absorption coefficient. Importantly, V-N co-doping successfully activates the inert basal plane of BP, allowing it to drive the HER under illumination (Delta G(H) = -0.12 eV). This study highlights the potential of nonprecious metal-nonmetal co-doping to enhance the photocatalytic activity of BP, providing invaluable insights for advancing the field of co-doped BP in photocatalysis.

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Community:

  • [ 1 ] [Luo, Luteng]Fujian Normal Univ, Coll Environm & Resource Sci, Coll Carbon Neutral Modern Ind, Fujian Key Lab Pollut Control & Resource Reuse, Fuzhou 350117, Peoples R China
  • [ 2 ] [Cui, Weiting]Fujian Normal Univ, Coll Environm & Resource Sci, Coll Carbon Neutral Modern Ind, Fujian Key Lab Pollut Control & Resource Reuse, Fuzhou 350117, Peoples R China
  • [ 3 ] [Xue, Hang]Fujian Normal Univ, Coll Environm & Resource Sci, Coll Carbon Neutral Modern Ind, Fujian Key Lab Pollut Control & Resource Reuse, Fuzhou 350117, Peoples R China
  • [ 4 ] [Ke, Sunzai]Fujian Normal Univ, Coll Environm & Resource Sci, Coll Carbon Neutral Modern Ind, Fujian Key Lab Pollut Control & Resource Reuse, Fuzhou 350117, Peoples R China
  • [ 5 ] [Yang, Xuhui]Fujian Normal Univ, Coll Environm & Resource Sci, Coll Carbon Neutral Modern Ind, Fujian Key Lab Pollut Control & Resource Reuse, Fuzhou 350117, Peoples R China
  • [ 6 ] [Yang, Min-Quan]Fujian Normal Univ, Coll Environm & Resource Sci, Coll Carbon Neutral Modern Ind, Fujian Key Lab Pollut Control & Resource Reuse, Fuzhou 350117, Peoples R China
  • [ 7 ] [Qian, Qingrong]Fujian Normal Univ, Coll Environm & Resource Sci, Coll Carbon Neutral Modern Ind, Fujian Key Lab Pollut Control & Resource Reuse, Fuzhou 350117, Peoples R China
  • [ 8 ] [Yang, Xuhui]Fuzhou Univ, State Key Lab Photocatalysis Energy & Environm, Fuzhou 350116, Peoples R China

Reprint 's Address:

  • [Yang, Xuhui]Fujian Normal Univ, Coll Environm & Resource Sci, Coll Carbon Neutral Modern Ind, Fujian Key Lab Pollut Control & Resource Reuse, Fuzhou 350117, Peoples R China;;[Qian, Qingrong]Fujian Normal Univ, Coll Environm & Resource Sci, Coll Carbon Neutral Modern Ind, Fujian Key Lab Pollut Control & Resource Reuse, Fuzhou 350117, Peoples R China;;[Yang, Xuhui]Fuzhou Univ, State Key Lab Photocatalysis Energy & Environm, Fuzhou 350116, Peoples R China;;

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Source :

NEW JOURNAL OF CHEMISTRY

ISSN: 1144-0546

Year: 2023

Issue: 3

Volume: 48

Page: 1141-1151

2 . 7

JCR@2023

2 . 7 0 0

JCR@2023

JCR Journal Grade:2

CAS Journal Grade:3

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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