Adsorption properties of NO molecules on the hexagonal LaCoO3 (0 0 1) surface: a density functional theory study-Reference-Cited by-同舟云学术

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

Published:2017 Issue:55 Volume:7 Page:34714-34721
ISSN:2046-2069
Container-title:RSC Advances
language:en
Short-container-title:RSC Adv.

Author:

Liu Zhijie¹²³⁴⁵,Wang Yanxin¹²³⁴⁵,Gao Hongwei¹²³⁴⁵^ORCID

Affiliation:

1. Key Laboratory of Plant Resources

2. Chemistry in Arid Regions

3. Xinjiang Technical Institute of Physics and Chemistry

4. Chinese Academy of Sciences

5. Urumqi 830011

Abstract

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

Funder

Natural Science Foundation of Xinjiang Province

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2017/RA/C7RA03213G

Reference47 articles.

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4. Structures and stability of ABO3 orthorhombic perovskites at the Earth's mantle conditions from first-principles theory

5. Achieving Economic and Environmental Sustainabilities in Urban Consolidation Center With Bicriteria Auction

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