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RESEARCH PAPER · Chemistry - A European Journal · 2019

A Hydride Route to Ternary Alkali Metal Borides: A Case Study of Lithium Nickel Borides

Volodymyr Gvozdetskyi, Michael P. Hanrahan, R. A. Ribeiro, Tae‐Hoon Kim, Lin Zhou, Aaron J. Rossini, Paul C. Canfield, Julia V. Zaikina

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A Hydride Route to Ternary Alkali Metal Borides: A Case Study of Lithium Nickel BoridesOriginalThermal Stability and Thermoelectric Properties of NaZnSb27Chemical and Electrochemical Lithiation of van der Waals Tetrel‐Arsenides20Computationally Driven Discovery of a Family of Layered LiNiB Polymorphs39Computationally Driven Discovery of a Family of Layered LiNiB Polymorphs9Directing Boron–Phosphorus Bonds in Crystalline Solid: Oxidative Polymerization of P═B═P Monomers into 1D Chains21From NaZn4Sb3 to HT-Na1–xZn4–ySb3: Panoramic Hydride Synthesis, Structural Diversity, and Thermoelectric Properties28Theoretical search for possible Li–Ni–B crystal structures using an adaptive genetic algorithm16Clathrate XI K58Zn122Sb207: A New Branch on the Clathrate Family Tree12Clathrate XI K58Zn122Sb207: A New Branch on the Clathrate Family Tree8Structure Determination of Boron-Based Oxidative Dehydrogenation Heterogeneous Catalysts With Ultrahigh Field 35.2 T 11B Solid-State NMR Spectroscopy66Lithium nickel borides: evolution of [NiB] layers driven by Li pressure14Improving sensitivity and resolution in solid-state nuclear magnetic resonance0Topochemical Deintercalation of Li from Layered LiNiB: toward 2D MBene81Ternary Zinc Antimonides Unlocked Using Hydride Synthesis14How to Look for Compounds: Predictive Screening and in situ Studies in Na−Zn−Bi System8Unconventional synthesis of novel borides: interplay between crystal structures, magnetic and catalytic properties0Path Less Traveled: A Contemporary Twist on Synthesis and Traditional Structure Solution of Metastable LiNi12B88The expanding frontier between mechanochemistry & solid state NMR: Special focus on inorganic components of materials1Hydride precursors in materials synthesis9The First Quaternary Phase of the NbRuB Structure Type: Experimental and Computational Investigations of TiFe1.3Os3.9B2.81Prediction of Van Hove singularity systems in ternary borides10Exploring the A -V-Sb landscape beyond AV3Sb5 : A case study on the KV6Sb6 Kagome compound9Breaking New Ground: MBene Route toward Selective Vinyl Double Bond Hydrogenation in Nitroarenes7Ternary Lithium Nickel Boride with 1D Rapid‐Ion‐Diffusion Channels as an Anode for Use in Lithium‐Ion Batteries16Venturing into Unexplored Phase Space: Synthesis, Structure, and Properties of MgCo3B2 Featuring a Rumpled Kagomé Network5Multifunctional Cubic Li2scb and Li2yb: Pressure-Tunable Bandgaps, Dirac Cones, and Ultralow Thermal Conductivity0Prediction of L i 3 F e 8 B 8 compound with rapid one-dimensional ion diffusion channels1Higher Dimensionality in the Mg–Co–B System: Synthesis and Structure of Incommensurate Composite Mg 1+ε Co 4 B 41Computational investigation of ternary Mg–Co–B compounds as cathode materials for Mg-ion batteries0Itinerant Magnetism in Hydride-Synthesized CaCo 12 B 60

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  1. Thermal Stability and Thermoelectric Properties of NaZnSb

    Materials · 2018-12-24

    Volodymyr Gvozdetskyi, Bryan Owens‐Baird, Sangki Hong, Julia V. Zaikina

    Read original paper ↗ ·

  2. Chemical and Electrochemical Lithiation of van der Waals Tetrel‐Arsenides

    Chemistry - A European Journal · 2019-03-19

    Justin Mark, Michael P. Hanrahan, Katherine E. Woo, Shannon Lee, Aaron J. Rossini, Kirill A. Kovnir

    Read original paper ↗ ·

  3. Computationally Driven Discovery of a Family of Layered LiNiB Polymorphs

    Angewandte Chemie International Edition · 2019-08-02

    Volodymyr Gvozdetskyi, Gourab Bhaskar, Maria Batuk, Xin Zhao, Renhai Wang, Scott L. Carnahan, Michael P. Hanrahan, Raquel A. Ribeiro, Paul C. Canfield, Aaron J. Rossini, Cai‐Zhuang Wang, Kai‐Ming Ho, Joke Hadermann, Julia V. Zaikina

    Read original paper ↗ ·

  4. Computationally Driven Discovery of a Family of Layered LiNiB Polymorphs

    Angewandte Chemie · 2019-08-02

    Volodymyr Gvozdetskyi, Gourab Bhaskar, Maria Batuk, Xin Zhao, Renhai Wang, Scott L. Carnahan, Michael P. Hanrahan, Raquel A. Ribeiro, Paul C. Canfield, Aaron J. Rossini, Cai‐Zhuang Wang, Kai‐Ming Ho, Joke Hadermann, Julia V. Zaikina

    Read original paper ↗ ·

  5. Directing Boron–Phosphorus Bonds in Crystalline Solid: Oxidative Polymerization of P═B═P Monomers into 1D Chains

    Journal of the American Chemical Society · 2019-08-06

    Katherine E. Woo, Jian Wang, Justin Mark, Kirill A. Kovnir

    Read original paper ↗ ·

  6. From NaZn4Sb3 to HT-Na1–xZn4–ySb3: Panoramic Hydride Synthesis, Structural Diversity, and Thermoelectric Properties

    Chemistry of Materials · 2019-10-03

    Volodymyr Gvozdetskyi, Bryan Owens‐Baird, Sangki Hong, Tori Cox, Gourab Bhaskar, Colin P. Harmer, Yang Sun, Feng Zhang, Cai‐Zhuang Wang, Kai‐Ming Ho, Julia V. Zaikina

    Read original paper ↗ ·

  7. Theoretical search for possible Li–Ni–B crystal structures using an adaptive genetic algorithm

    Journal of Applied Physics · 2020-03-02

    Renhai Wang, Yang Sun, Volodymyr Gvozdetskyi, Xin Zhao, Feng Zhang, Linhan Xu, Julia V. Zaikina, Zijing Lin, Cai‐Zhuang Wang, Kai‐Ming Ho

    Read original paper ↗ ·

  8. Clathrate XI K58Zn122Sb207: A New Branch on the Clathrate Family Tree

    Angewandte Chemie International Edition · 2020-09-16

    Tori Cox, Volodymyr Gvozdetskyi, Mark Bertolami, Shannon Lee, Kristian Shipley, Oleg I. Lebedev, Julia V. Zaikina

    Read original paper ↗ ·

  9. Clathrate XI K58Zn122Sb207: A New Branch on the Clathrate Family Tree

    Angewandte Chemie · 2020-09-16

    Tori Cox, Volodymyr Gvozdetskyi, Mark Bertolami, Shannon Lee, Kristian Shipley, Oleg I. Lebedev, Julia V. Zaikina

    Read original paper ↗ ·

  10. Structure Determination of Boron-Based Oxidative Dehydrogenation Heterogeneous Catalysts With Ultrahigh Field 35.2 T 11B Solid-State NMR Spectroscopy

    ACS Catalysis · 2020-11-16

    Rick W. Dorn, Melissa C. Cendejas, Kuizhi Chen, Ivan Hung, Natalie R. Altvater, William P. McDermott, Zhehong Gan, Ive Hermans, Aaron J. Rossini

    Read original paper ↗ ·

  11. Lithium nickel borides: evolution of [NiB] layers driven by Li pressure

    Inorganic Chemistry Frontiers · 2020-11-25

    Volodymyr Gvozdetskyi, Yang Sun, Xin Zhao, Gourab Bhaskar, Scott L. Carnahan, Colin P. Harmer, Feng Zhang, Raquel A. Ribeiro, Paul C. Canfield, Aaron J. Rossini, Cai‐Zhuang Wang, Kai‐Ming Ho, Julia V. Zaikina

    Read original paper ↗ ·

  12. Improving sensitivity and resolution in solid-state nuclear magnetic resonance

    Unknown journal · 2021-01-01

    Scott L. Carnahan

    Read original paper ↗ ·

  13. Topochemical Deintercalation of Li from Layered LiNiB: toward 2D MBene

    Journal of the American Chemical Society · 2021-03-15

    Gourab Bhaskar, Volodymyr Gvozdetskyi, Maria Batuk, Kamila Magdalena Wiaderek, Yang Sun, Renhai Wang, Chao Zhang, Scott L. Carnahan, Xun Wei Wu, Raquel A. Ribeiro, Sergey L. Bud’ko, Paul C. Canfield, Wenyu Huang, Aaron J. Rossini, Cai‐Zhuang Wang, Kai‐Ming Ho, Joke Hadermann, Julia V. Zaikina

    Read original paper ↗ ·

  14. Ternary Zinc Antimonides Unlocked Using Hydride Synthesis

    Inorganic Chemistry · 2021-06-28

    Volodymyr Gvozdetskyi, Shannon Lee, Bryan Owens‐Baird, Juli‐Anna Dolyniuk, Tori Cox, Renhai Wang, Zijing Lin, Kai‐Ming Ho, Julia V. Zaikina

    Read original paper ↗ ·

  15. How to Look for Compounds: Predictive Screening and in situ Studies in Na−Zn−Bi System

    Chemistry - A European Journal · 2021-09-01

    Volodymyr Gvozdetskyi, Renhai Wang, Weiyi Xia, Feng Zhang, Zijing Lin, Kai‐Ming Ho, Gordon J. Miller, Julia V. Zaikina

    Read original paper ↗ ·

  16. Unconventional synthesis of novel borides: interplay between crystal structures, magnetic and catalytic properties

    Unknown journal · 2022-01-01

    Gourab Bhaskar

    Read original paper ↗ ·

  17. Path Less Traveled: A Contemporary Twist on Synthesis and Traditional Structure Solution of Metastable LiNi12B8

    ACS Materials Au · 2022-06-10

    Gourab Bhaskar, Volodymyr Gvozdetskyi, Scott L. Carnahan, Renhai Wang, Aishwarya Mantravadi, Xun Wei Wu, Raquel A. Ribeiro, Wenyu Huang, Aaron J. Rossini, Kai‐Ming Ho, Paul C. Canfield, Oleg I. Lebedev, Julia V. Zaikina

    Read original paper ↗ ·

  18. The expanding frontier between mechanochemistry & solid state NMR: Special focus on inorganic components of materials

    Elsevier eBooks · 2022-09-24

    César Leroy, Thomas‐Xavier Métro, Danielle Laurencin

    Read original paper ↗ ·

  19. Hydride precursors in materials synthesis

    Elsevier eBooks · 2022-10-15

    Adedoyin N. Adeyemi, Gourab Bhaskar, Tori Cox, Sangki Hong, Volodymyr Gvozdetskyi, Julia V. Zaikina

    Read original paper ↗ ·

  20. The First Quaternary Phase of the NbRuB Structure Type: Experimental and Computational Investigations of TiFe1.3Os3.9B2.8

    Zeitschrift für anorganische und allgemeine Chemie · 2023-08-19

    Kate A. Gibson, Michael Küpers, Boniface P. T. Fokwa

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  21. Prediction of Van Hove singularity systems in ternary borides

    npj Computational Materials · 2023-10-28

    Yang Sun, Zhen Zhang, Andrew P. Porter, Kirill A. Kovnir, Kai‐Ming Ho, Vladimir Antropov

    Read original paper ↗ ·

  22. Exploring the A -V-Sb landscape beyond AV3Sb5 : A case study on the KV6Sb6 Kagome compound

    Physical Review Materials · 2023-11-15

    Aishwarya Mantravadi, Volodymyr Gvozdetskyi, Arka Sarkar, Yaroslav Mudryk, Julia V. Zaikina

    Read original paper ↗ ·

  23. Breaking New Ground: MBene Route toward Selective Vinyl Double Bond Hydrogenation in Nitroarenes

    Journal of the American Chemical Society · 2023-12-07

    Gourab Bhaskar, Ranjan Kumar Behera, Volodymyr Gvozdetskyi, Scott L. Carnahan, Raquel A. Ribeiro, Paul Oftedahl, Charles Ward, Paul C. Canfield, Aaron J. Rossini, Wenyu Huang, Julia V. Zaikina

    Read original paper ↗ ·

  24. Ternary Lithium Nickel Boride with 1D Rapid‐Ion‐Diffusion Channels as an Anode for Use in Lithium‐Ion Batteries

    Small · 2023-12-12

    Wei Liu, Kai Zong, Usman ul Ghani, Ali Saad, Dongqing Liu, Yonggui Deng, Waseem Raza, Ying Li, Arshad Hussain, Pengfei Ye, Zhaoqi Song, Xingke Cai

    Read original paper ↗ ·

  25. Venturing into Unexplored Phase Space: Synthesis, Structure, and Properties of MgCo3B2 Featuring a Rumpled Kagomé Network

    Chemistry of Materials · 2024-09-27

    Paul Oftedahl, Nawsher J. Parvez, Zhen Zhang, Yang Sun, Vladimir Antropov, John Q. Xiao, Julia V. Zaikina

    Read original paper ↗ ·

  26. Multifunctional Cubic Li2scb and Li2yb: Pressure-Tunable Bandgaps, Dirac Cones, and Ultralow Thermal Conductivity

    SSRN Electronic Journal · 2025-01-01

    Bohan Cao, Xinwei Wang, Yibo Sun, Mengxin Yang, Defang Duan, Fubo Tian, Tianhong Cui

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  27. Prediction of L i 3 F e 8 B 8 compound with rapid one-dimensional ion diffusion channels

    Physical Review Materials · 2025-10-03

    Shiya Chen, Paul Oftedahl, Zhen Zhang, Zepeng Wu, Junjie Jiang, Vladimir Antropov, Julia V. Zaikina, Shunqing Wu, Kai‐Ming Ho, Yang Sun

    Read original paper ↗ ·

  28. Higher Dimensionality in the Mg–Co–B System: Synthesis and Structure of Incommensurate Composite Mg 1+ε Co 4 B 4

    Journal of the American Chemical Society · 2025-12-10

    Paul Oftedahl, Gourab Bhaskar, Nawsher J. Parvez, Zhen Zhang, Yang Sun, John Q. Xiao, Thomas E. Proffen, Oleg I. Lebedev, Julia V. Zaikina

    Read original paper ↗ ·

  29. Computational investigation of ternary Mg–Co–B compounds as cathode materials for Mg-ion batteries

    Physical Chemistry Chemical Physics · 2026-01-01

    Somnath Paitandi, Shivansh Upadhyay, Kalishankar Bhattacharyya

    Read original paper ↗ ·

  30. Itinerant Magnetism in Hydride-Synthesized CaCo 12 B 6

    Inorganic Chemistry · 2026-01-12

    Thomas A. Seymour-Cozzini, Volodymyr Gvozdetskyi, Z Zhang, Paul Oftedahl, Hayley P. Masching, William Howard Josul, Nawsher J. Parvez, John Q. Xiao, V. P. Antropov, Julia V. Zaikina

    Read original paper ↗ ·
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