First-principles structural design of superhard materials.
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Influences of carbon concentration on crystal structures and ideal strengths of B2CxO compounds in the B-C-O system.Perspective: crystal structure prediction at high pressures.The Mechanical and Electronic Properties of Carbon-Rich Silicon Carbide.A Novel Silicon Allotrope in the Monoclinic Phase.Pnma-BN: Another Boron Nitride Polymorph with Interesting Physical Properties.A Reinvestigation of a Superhard Tetragonal sp³ Carbon Allotrope.Orthorhombic C32: a novel superhard sp3 carbon allotrope.Two B-C-O Compounds: Structural, Mechanical Anisotropy and Electronic Properties under Pressure.From properties to materials: An efficient and simple approach.Structure, stability, and superconductivity of new Xe-H compounds under high pressure.Globally stable structures of LixZn (x = 1-4) compounds at high pressures.High-Energy Density and Superhard Nitrogen-Rich B-N Compounds.Theoretical Investigations of the Hexagonal Germanium Carbonitride.Structural prediction of ultrahard semi-titanium boride (Ti2B) using the frozen-phonon method.Oxysulfide LiAlSO: A Lithium Superionic Conductor from First Principles.Pathways to exotic metastable silicon allotropesStructure determination of (Fe3O4)n+(n = 1 − 3) clusters via DFT
P2860
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P2860
First-principles structural design of superhard materials.
description
2013 nî lūn-bûn
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2013年の論文
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2013年学术文章
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2013年学术文章
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2013年学术文章
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2013年学术文章
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2013年学术文章
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2013年学术文章
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2013年學術文章
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2013年學術文章
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name
First-principles structural design of superhard materials.
@en
First-principles structural design of superhard materials.
@nl
type
label
First-principles structural design of superhard materials.
@en
First-principles structural design of superhard materials.
@nl
prefLabel
First-principles structural design of superhard materials.
@en
First-principles structural design of superhard materials.
@nl
P2093
P2860
P356
P1476
First-principles structural design of superhard materials.
@en
P2093
Chunye Zhu
Miao Zhang
Xinxin Zhang
Yanchao Wang
Yanming Ma
P2860
P304
P356
10.1063/1.4794424
P407
P577
2013-03-01T00:00:00Z