Highly efficient catalytic activity for the hydrogen evolution reaction on pristine and monovacancy defected WP systems: a first-principles investigation

2018 ◽  
Vol 20 (20) ◽  
pp. 13757-13764 ◽  
Author(s):  
Yanfeng Ma ◽  
Guangtao Yu ◽  
Ting Wang ◽  
Chenghui Zhang ◽  
Xuri Huang ◽  
...  

A deep understanding of HER catalytic activity of tungsten phosphide at the atomic level and its effective improvement by introducing a monovacancy.

2021 ◽  
Author(s):  
Changhai Liu ◽  
Yanhua Yao ◽  
Lei Sun ◽  
Linlin Luo ◽  
Wenchang Wang ◽  
...  

Herein, we present hierarchical Mo-doped NiCoP@carbon microspheres, which exhibits noticeable enhancement of catalytic activity and fast kinetics for hydrogen evolution. An overpotentials of 74.6 mV at 10 mA cm-2 and...


2018 ◽  
Vol 20 (15) ◽  
pp. 10407-10417 ◽  
Author(s):  
Zengsong Zhang ◽  
Guangtao Yu ◽  
Hui Li ◽  
Jingwei Liu ◽  
Xuri Huang ◽  
...  

Deep understanding at the atomic level of the HER catalytic activity of Cu3P and its significant enhancement by surface-doped Ni atoms.


2020 ◽  
Vol 8 (3) ◽  
pp. 1307-1314 ◽  
Author(s):  
Abdul Jalil ◽  
Zhiwen Zhuo ◽  
Zhongti Sun ◽  
Fang Wu ◽  
Chuan Wang ◽  
...  

Phosphorene-like InP3 is reported with first-principles calculations, which is a direct-bandgap semiconductor with anisotropic carrier mobility and high catalytic activity toward the hydrogen evolution reaction.


2020 ◽  
Vol 8 (4) ◽  
pp. 2090-2098 ◽  
Author(s):  
Lu Li ◽  
Gengwei Zhang ◽  
Bin Wang ◽  
Tao Yang ◽  
Shengchun Yang

The synergistic effect between Pt and Ru in PtRu/CC1500 catalyst results in a promising catalytic activity toward HER, which displays a performance dozens of times higher than that of commercial Pt/C.


2017 ◽  
Vol 19 (28) ◽  
pp. 18356-18365 ◽  
Author(s):  
Da Young Hwang ◽  
Kyoung Hwan Choi ◽  
Jeong Eon Park ◽  
Dong Hack Suh

Our strategy begins with MoS2 sheets decorated with Pt NPs and their scrolls (called MoS2@Pt scrolls) with intrinsic bending strain (2.4%) to provide the phase transition from the 2H to the 1T phase (28%). MoS2@Pt scrolls have the amount of Pt NPs (8.3 wt%) and high catalytic activity (39 mV per decade).


Nanoscale ◽  
2019 ◽  
Vol 11 (21) ◽  
pp. 10402-10409 ◽  
Author(s):  
Jing Pan ◽  
Rui Wang ◽  
Xiaoyong Xu ◽  
Jingguo Hu ◽  
Liang Ma

Non-noble transition metals Mo and Cr doping greatly enhances the basal-plane catalytic activity of two-dimensional 1T′-ReS2 for hydrogen evolution reaction as comparable with those of Pt-doping.


2019 ◽  
Vol 7 (5) ◽  
pp. 2334-2343 ◽  
Author(s):  
In Hye Kwak ◽  
Ik Seon Kwon ◽  
Hafiz Ghulam Abbas ◽  
Jaemin Seo ◽  
Gabin Jung ◽  
...  

Two-dimensional 1T′ phase MoS2 that was intercalated with a series of alkylated p-phenylenediamines exhibits excellent catalytic activity toward hydrogen evolution reaction, supported by first-principles calculations.


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