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Published in 2022 at "Advanced Materials"
DOI: 10.1002/adma.202208724
Abstract: A distinct type of metavalent bonding (MVB) is recently proposed to explain an unusual combination of anomalous functional properties of group IV chalcogenide crystals, whose electronic mechanisms and origin remain controversial. Through theoretical analysis of…
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Keywords:
bonding origins;
metavalent bonding;
group;
properties group ... See more keywords
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Published in 2019 at "Physical Review B"
DOI: 10.1103/physrevb.100.045204
Abstract: Powered by TCPDF (www.tcpdf.org) This material is protected by copyright and other intellectual property rights, and duplication or sale of all or part of any of the repository collections is not permitted, except that material…
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Keywords:
center gan;
properties ry3;
unusual properties;
ry3 center ... See more keywords
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Published in 2022 at "Physical review letters"
DOI: 10.1103/physrevlett.128.077601
Abstract: Hybrid organic-inorganic perovskites is a class of materials with diverse chemically tunable properties and outstanding potential for multifunctionality. We use first-principles simulations to predict room temperature ferroelectricity in a representative of the formate family, [NH_{2}NH_{3}][Co(HCOO)_{3}].…
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Keywords:
properties hydrogen;
bonded ferroelectrics;
hydrogen;
ferroelectrics case ... See more keywords