First Principles Study of Nitrogen Doping at the Anatase TiO2(101) Surface

Emanuele Finazzi; Cristiana Di Valentin; Annabella Selloni; Gianfranco Pacchioni

doi:10.1021/jp071186s

First Principles Study of Nitrogen Doping at the Anatase TiO2(101) Surface

The Journal of Physical Chemistry C ◽

10.1021/jp071186s ◽

2007 ◽

Vol 111 (26) ◽

pp. 9275-9282 ◽

Cited By ~ 108

Author(s):

Emanuele Finazzi ◽

Cristiana Di Valentin ◽

Annabella Selloni ◽

Gianfranco Pacchioni

Keyword(s):

First Principles ◽

Nitrogen Doping ◽

Anatase Tio2 ◽

First Principles Study

Download Full-text

First-Principles Study of La Doping Effects on the Electronic Structures and Photocatalytic Properties of Anatase TiO2

Chinese Journal of Chemical Physics ◽

10.1063/1674-0068/28/cjcp1503038 ◽

2015 ◽

Vol 28 (6) ◽

pp. 681-687 ◽

Cited By ~ 1

Author(s):

Ping Huang ◽

Bo Shang ◽

Ling-jie Li ◽

Jing-lei Lei

Keyword(s):

First Principles ◽

Electronic Structures ◽

Anatase Tio2 ◽

Photocatalytic Properties ◽

La Doping ◽

First Principles Study ◽

Doping Effects

Download Full-text

First-principles study of CO adsorption on Os atom doped anatase TiO2 (1 0 1) surface

Polyhedron ◽

10.1016/j.poly.2020.114814 ◽

2020 ◽

Vol 191 ◽

pp. 114814

Author(s):

Long Lin ◽

Zhengguang Shi ◽

Longbin Yan ◽

Hualong Tao ◽

Linwei Yao ◽

...

Keyword(s):

First Principles ◽

Co Adsorption ◽

Anatase Tio2 ◽

First Principles Study

Download Full-text

First-principles study on anatase TiO2(101) surface adsorption of NO

Chinese Physics B ◽

10.1088/1674-1056/23/4/043101 ◽

2014 ◽

Vol 23 (4) ◽

pp. 043101 ◽

Cited By ~ 4

Author(s):

Qing Feng ◽

Yuan-Xia Yue ◽

Wei-Hua Wang ◽

Hong-Qiang Zhu

Keyword(s):

First Principles ◽

Surface Adsorption ◽

Anatase Tio2 ◽

First Principles Study

Download Full-text

Role of photoexcited electrons in hydrogen evolution from platinum co-catalysts loaded on anatase TiO2: a first-principles study

Journal of Materials Chemistry A ◽

10.1039/c3ta10249a ◽

2013 ◽

Vol 1 (22) ◽

pp. 6664 ◽

Cited By ~ 17

Author(s):

Adisak Boonchun ◽

Naoto Umezawa ◽

Takahisa Ohno ◽

Shuxin Ouyang ◽

Jinhua Ye

Keyword(s):

Hydrogen Evolution ◽

First Principles ◽

Anatase Tio2 ◽

Co Catalysts ◽

First Principles Study

Download Full-text

First-principles study of Mn-S codoped anatase TiO2

Materials Research Express ◽

10.1088/2053-1591/aab868 ◽

2018 ◽

Vol 5 (4) ◽

pp. 045005 ◽

Cited By ~ 2

Author(s):

Senlin Li ◽

Jinliang Huang ◽

Xiangmei Ning ◽

Yongcha Chen ◽

Qingkui Shi

Keyword(s):

First Principles ◽

Anatase Tio2 ◽

First Principles Study

Download Full-text

The effect of Ta dopant on the electronic and optical properties of anatase TiO2: a first-principles study

Materials Research Express ◽

10.1088/2053-1591/aa5733 ◽

2017 ◽

Vol 4 (2) ◽

pp. 024002 ◽

Cited By ~ 13

Author(s):

Shibghatullah Muhammady ◽

Eka Nurfani ◽

Robi Kurniawan ◽

Inge Magdalena Sutjahja ◽

Toto Winata ◽

...

Keyword(s):

Optical Properties ◽

First Principles ◽

Anatase Tio2 ◽

Electronic And Optical Properties ◽

First Principles Study

Download Full-text

First principles study of the electronic structure and magnetism of oxygen-deficient anatase TiO2 (001) surface

Applied Surface Science ◽

10.1016/j.apsusc.2013.11.165 ◽

2014 ◽

Vol 292 ◽

pp. 475-479 ◽

Cited By ~ 15

Author(s):

Min Wang ◽

Min Feng ◽

Xu Zuo

Keyword(s):

Electronic Structure ◽

First Principles ◽

Anatase Tio2 ◽

First Principles Study

Download Full-text

First-principles study on the electronic structures and absorption spectra of Sm-N codoped anatase TiO2

Acta Physica Sinica ◽

10.7498/aps.61.167103 ◽

2012 ◽

Vol 61 (16) ◽

pp. 167103

Author(s):

Li Cong ◽

Hou Qing-Yu ◽

Zhang Zhen-Duo ◽

Zhao Chun-Wang ◽

Zhang Bing

Keyword(s):

Absorption Spectra ◽

First Principles ◽

Electronic Structures ◽

Anatase Tio2 ◽

First Principles Study

Download Full-text

Interplay of hydrogen treatment and nitrogen doping in ZnO nanoparticles: a first-principles study

Nanotechnology ◽

10.1088/0957-4484/25/14/145204 ◽

2014 ◽

Vol 25 (14) ◽

pp. 145204 ◽

Cited By ~ 6

Author(s):

Johann Gutjahr ◽

Sung Sakong ◽

Peter Kratzer

Keyword(s):

Zno Nanoparticles ◽

First Principles ◽

Nitrogen Doping ◽

Hydrogen Treatment ◽

First Principles Study

Download Full-text

First-principles study of the electronic and optical properties of the (Eu,N)-codoped anatase TiO2 photocatalyst

Computational Materials Science ◽

10.1016/j.commatsci.2012.09.021 ◽

2013 ◽

Vol 68 ◽

pp. 234-237 ◽

Cited By ~ 6

Author(s):

Zhenyi Jiang ◽

Yanming Lin ◽

Ting Mei ◽

Xiaoyun Hu ◽

Wenzhou Chen ◽

...

Keyword(s):

Optical Properties ◽

First Principles ◽

Anatase Tio2 ◽

Tio2 Photocatalyst ◽

Electronic And Optical Properties ◽

First Principles Study ◽

The Eu

Download Full-text