Cargando…

A New Superhard Phase and Physical Properties of ZrB(3) from First-Principles Calculations

Using the first-principles particle swarm optimization algorithm for crystal structural prediction, we have predicted a novel monoclinic C2/m structure for ZrB(3), which is more energetically favorable than the previously proposed FeB(3)-, TcP(3)-, MoB(3)-, WB(3)-, and OsB(3)-type structures in the...

Descripción completa

Detalles Bibliográficos
Autores principales:	Zhang, Gangtai, Bai, Tingting, Zhao, Yaru, Hu, Yanfei
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	MDPI 2016
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5512525/ https://www.ncbi.nlm.nih.gov/pubmed/28773831 http://dx.doi.org/10.3390/ma9080703

Ejemplares similares

Microstructural and nanoindentation study of TaN incorporated ZrB(2) and ZrB(2)–SiC ceramics
por: Delbari, Seyed Ali, et al.
Publicado: (2022)

RF Thermal Plasma Synthesis of Ultrafine ZrB(2)-ZrC Composite Powders
por: Bai, Liuyang, et al.
Publicado: (2020)

Progress in Preparation of ZrB(2) Nanopowders Based on Traditional Solid-State Synthesis
por: Bai, Liuyang, et al.
Publicado: (2021)

Complex spectral evolution in a BCS superconductor, ZrB(12)
por: Thakur, Sangeeta, et al.
Publicado: (2013)

ZrB(2)-CNTs Nanocomposites Fabricated by Spark Plasma Sintering
por: Jin, Hua, et al.
Publicado: (2016)

The ZrO(2) Formation in ZrB(2)/SiC Composite Irradiated by Laser
por: Liu, Ling, et al.
Publicado: (2015)

Effect of Milling on the Mechanical Properties of Chopped SiC Fiber-Reinforced ZrB(2)
por: Pienti, L., et al.
Publicado: (2013)

Microstructure and Mechanical Properties of ZrB(2)–HfC Ceramics Influenced by HfC Addition
por: Jing, Yi, et al.
Publicado: (2018)

Influence of ZrB(2) on Microstructure and Properties of Steel Matrix Composites Prepared by Spark Plasma Sintering
por: Sulima, Iwona, et al.
Publicado: (2020)

In Situ ZrB(2) Formation in B(4)C Ceramics and Its Strengthening Mechanism on Mechanical Properties
por: Yao, Wankai, et al.
Publicado: (2022)

Microstructure and high-temperature strength of textured and non-textured ZrB(2) ceramics
por: Wu, Wen-Wen, et al.
Publicado: (2013)

Effect of Repeated Thermal Shock on Mechanical Properties of ZrB(2)-SiC-BN Ceramic Composites
por: Li, Gang, et al.
Publicado: (2014)

Reaction Mechanism of ZrB(2)-ZrC Formation in Ni-Zr-B(4)C System Analyzed by Differential Scanning Calorimetry
por: Xu, Jiaying, et al.
Publicado: (2021)

Microstructure and Properties of ZrB(2)-SiC Reinforced Copper Matrix Composite Coatings Prepared by Laser Cladding
por: Zhao, Yuehong, et al.
Publicado: (2022)

Synthesis of In Situ ZrB(2)-SiC-ZrC Coating on ZrC-SiC Substrate by Reactive Plasma Spraying
por: Ma, Bao-Xia, et al.
Publicado: (2022)

Structure and Properties of Zr-Mo-Si-B-(N) Hard Coatings Obtained by d.c. Magnetron Sputtering of ZrB(2)-MoSi(2) Target
por: Kiryukhantsev-Korneev, Philipp, et al.
Publicado: (2021)

In Situ Formation of ZrB(2) and Its Influence on Wear and Mechanical Properties of ADC12 Alloy Mixed Matrix Composites
por: Prasad, Lalta, et al.
Publicado: (2021)

Co-Dispersion Behavior of ZrB(2)–SiC–B(4)C–C Powders with Polyethyleneimine
por: Yin, Jie, et al.
Publicado: (2013)

Plasma Oscillatory Pressure Sintering of Mo-9Si-8B Alloy with ZrB(2) Addition
por: Ding, Xiangyu, et al.
Publicado: (2022)

The Oxidation Behavior of ZrB(2)-SiC Ceramic Composites Fabricated by Plasma Spray Process
por: Alosime, Eid M., et al.
Publicado: (2021)

Formation of Thick Immersion Coatings and Residual Stress Evaluation in the System ZrB(2)–ZrO(2): Experimental and Numerical Investigation
por: Buyakov, Ales, et al.
Publicado: (2023)

Understanding the nature of “superhard graphite”
por: Boulfelfel, Salah Eddine, et al.
Publicado: (2012)

Effect of Zr(2)Al(4)C(5) Content on the Mechanical Properties and Oxidation Behavior of ZrB(2)-SiC-Zr(2)Al(4)C(5) Ceramics
por: Guo, Qilong, et al.
Publicado: (2023)

Reaction Behavior and Formation Mechanism of ZrB(2) and ZrC from the Ni-Zr-B(4)C System during Self-Propagating High-Temperature Synthesis
por: Xu, Jiaying, et al.
Publicado: (2022)

Microstructure Evolution and Mechanical Properties of Needle-like ZrB(2) Reinforced Cu Composites Manufactured by Laser Direct Energy Deposition
por: Lv, Xiangzhe, et al.
Publicado: (2022)

Microstructure and Ablation Behavior of Low-Pressure Plasma Sprayed ZrB(2) Coatings Down to 100 Pa
por: Wang, Di, et al.
Publicado: (2021)

Colloidal Processing of Complex-Shaped ZrB(2)-Based Ultra-High-Temperature Ceramics: Progress and Prospects
por: Liu, Guoqian, et al.
Publicado: (2022)

ZrB(2)/SiCN Thin-Film Strain Gauges for In-Situ Strain Detection of Hot Components
por: Lin, Fan, et al.
Publicado: (2022)

Mechanical Properties and Deformation Behavior of Superhard Lightweight Nanocrystalline Ceramics
por: Jeong, Byeongyun, et al.
Publicado: (2022)

Deposition of diamond-like superhard materials
por: Kulisch, W
Publicado: (1999)

Polytypism in superhard transition-metal triborides
por: Liang, Yongcheng, et al.
Publicado: (2014)

First principles calculations of the thermodynamic stability of Ba, Zr, and O vacancies in BaZrO(3)
por: Raja, N., et al.
Publicado: (2019)

Structural, Electronic, and Mechanical Properties of Zr(2)SeB and Zr(2)SeN from First-Principle Investigations
por: Bai, Xiaojing, et al.
Publicado: (2023)

Reducing the Ideal Shear Strengths of ZrB(2) by High Efficient Alloying Elements (Ag, Au, Pd and Pt)
por: Dai, Fu-Zhi, et al.
Publicado: (2017)

Physical Properties of XN (X = B, Al, Ga, In) in the Pm−3n phase: First-Principles Calculations
por: Zhang, Qidong, et al.
Publicado: (2020)

Effects of Multi-Components on the Microwave Absorption and Dielectric Properties of Plasma-Sprayed Carbon Nanotube/Y(2)O(3)/ZrB(2) Ceramics
por: Li, Rong, et al.
Publicado: (2021)

Synthesis of an Al-Based Composite Reinforced by Multi-Phase ZrB(2), Al(3)BC and Al(2)O(3) with Good Mechanical and Thermal Properties at Elevated Temperature
por: Bian, Yihan, et al.
Publicado: (2020)

Elastic Properties and Electronic Properties of M(x)N(y) (M = Ti, Zr) from First Principles Calculations
por: Ji, Yangqi, et al.
Publicado: (2018)

Polymorphs of the Gadolinite‐Type Borates ZrB(2)O(5) and HfB(2)O(5) Under Extreme Pressure
por: Pakhomova, Anna, et al.
Publicado: (2021)

Effect of SiC Content on the Ablation and Oxidation Behavior of ZrB(2)-Based Ultra High Temperature Ceramic Composites
por: Hu, Ping, et al.
Publicado: (2013)

Cannot write session to /tmp/vufind_sessions/sess_rrmgj361u58rgje62mdi6vvcv2