scholarly journals Correction: Adsorption properties of NO molecules on the hexagonal LaCoO3 (0 0 1) surface: a density functional theory study

RSC Advances ◽  
2018 ◽  
Vol 8 (45) ◽  
pp. 25444-25444
Author(s):  
Zhijie Liu ◽  
Yanxin Wang ◽  
Hongwei Gao
Keyword(s):  
Density Functional Theory ◽  
Density Functional ◽  
Adsorption Properties ◽  
Density Functional Theory Study ◽  
Functional Theory

Correction for ‘Adsorption properties of NO molecules on the hexagonal LaCoO3 (0 0 1) surface: a density functional theory study’ by Zhijie Liu et al., RSC Adv., 2017, 7, 34714–34721.

scholarly journals Adsorption properties of NO molecules on the hexagonal LaCoO3 (0 0 1) surface: a density functional theory study

RSC Advances ◽  
2017 ◽  
Vol 7 (55) ◽  
pp. 34714-34721 ◽  
Author(s):  
Zhijie Liu ◽  
Yanxin Wang ◽  
Hongwei Gao
Keyword(s):  
Density Functional Theory ◽  
Density Functional ◽  
Adsorption Properties ◽  
Density Functional Theory Study ◽  
No Adsorption ◽  
Functional Theory ◽  
Adsorption Sites

Six types of adsorption configurations, together with two different adsorption sites for NO adsorption on LaCoO3, were investigated via density functional theory.

Adsorption properties of trifluoroacetic acid on anatase (101) and (001) surfaces: a density functional theory study

2015 ◽  
Vol 17 (36) ◽  
pp. 23627-23633 ◽  
Author(s):  
Oriol Lamiel-Garcia ◽  
Daniel Fernandez-Hevia ◽  
Amador C. Caballero ◽  
Francesc Illas
Keyword(s):  
Density Functional Theory ◽  
Trifluoroacetic Acid ◽  
Density Functional ◽  
Growth Control ◽  
Control Agent ◽  
Adsorption Properties ◽  
Density Functional Theory Study ◽  
Functional Theory

Trifluoroacetic acid adsorbs preferentially on the TiO2(001) surface working as a growth control agent.

Mechanistic insight into the selective catalytic reduction of NO by NH3 over α-Fe2O3 (001): a density functional theory study

2019 ◽  
Vol 9 (1) ◽  
pp. 116-124 ◽  
Author(s):  
Qilong Fang ◽  
Baozhong Zhu ◽  
Yunlan Sun ◽  
Zicheng Zhu ◽  
Minggao Xu ◽  
...  
Keyword(s):  
Density Functional Theory ◽  
Selective Catalytic Reduction ◽  
Density Functional ◽  
Catalytic Reduction ◽  
Adsorption Properties ◽  
Density Functional Theory Study ◽  
Functional Theory ◽  
Reduction Of No ◽  
Mechanistic Insight ◽  
Insight Into

The adsorption properties and the selective catalytic reduction mechanism of NO, NH3 and O2 molecules over the α-Fe2O3 (001) surface were studied by density functional theory.

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