Literature DB >> 9976841

Ab initio study of MnO and NiO.

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Abstract

Year:  1994        PMID： 9976841     DOI： 10.1103/physrevb.50.5041

Source DB:  PubMed          Journal:  Phys Rev B Condens Matter        ISSN： 0163-1829


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  8 in total

1.  Unraveling the MnMoO4 polymorphism: a comprehensive DFT investigation of α, β, and ω phases.

Authors:  Luis Henrique da Silveira Lacerda; Miguel Angel San-Miguel
Journal:  J Mater Sci       Date:  2022-05-23       Impact factor: 4.682

2.  Band Gap Engineering of Newly Discovered ZnO/ZnS Polytypic Nanomaterials.

Authors:  Dejan Zagorac; Jelena Zagorac; Milan Pejić; Branko Matović; Johann Christian Schön
Journal:  Nanomaterials (Basel)       Date:  2022-05-08       Impact factor: 5.719

3.  Stability of xenon oxides at high pressures.

Authors:  Qiang Zhu; Daniel Y Jung; Artem R Oganov; Colin W Glass; Carlo Gatti; Andriy O Lyakhov
Journal:  Nat Chem       Date:  2012-11-11       Impact factor: 24.427

4.  How close are the Slater and Becke-Roussel potentials in solids?

Authors:  Fabien Tran; Peter Blaha; Karlheinz Schwarz
Journal:  J Chem Theory Comput       Date:  2015-10-13       Impact factor: 6.006

5.  Vacancy Defects in Ga2O3: First-Principles Calculations of Electronic Structure.

Authors:  Abay Usseinov; Zhanymgul Koishybayeva; Alexander Platonenko; Vladimir Pankratov; Yana Suchikova; Abdirash Akilbekov; Maxim Zdorovets; Juris Purans; Anatoli I Popov
Journal:  Materials (Basel)       Date:  2021-12-02       Impact factor: 3.623

6.  Detection of toxic choline based on Mn2O3/NiO nanomaterials by an electrochemical method.

Authors:  Mohammed M Rahman; M M Alam; Abdullah M Asiri
Journal:  RSC Adv       Date:  2019-10-31       Impact factor: 4.036

7.  Unraveling the relationship between exposed surfaces and the photocatalytic activity of Ag3PO4: an in-depth theoretical investigation.

Authors:  Felipe Lipsky; Luis Henrique da Silveira Lacerda; Sérgio Ricardo de Lazaro; Elson Longo; Juan Andrés; Miguel Angel San-Miguel
Journal:  RSC Adv       Date:  2020-08-18       Impact factor: 4.036

8.  Graphene and novel graphitic ZnO and ZnS nanofilms: the energy landscape, non-stoichiometry and water dissociation.

Authors:  Sergio Conejeros; Neil L Allan; Frederik Claeyssens; Judy N Hart
Journal:  Nanoscale Adv       Date:  2019-04-01
  8 in total

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