Inorganic Chemistry

, том 56 , издание 7 , страницы 3901-3908

Pressure-Stabilized Superconductive Ionic Tantalum Hydrides.

Тип публикации: Journal Article

Дата публикации: 2017-03-16

American Chemical Society (ACS)

Inorganic Chemistry

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wos Q1

white level БС1

SJR: 0.958

CiteScore: 7.4

Impact factor: 4.7

ISSN: 00201669, 1520510X

DOI: 10.1021/acs.inorgchem.6b02822

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PubMed ID: 28300399

Inorganic Chemistry

Physical and Theoretical Chemistry

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High-pressure structures of tantalum hydrides were investigated over a wide pressure range of 0-300 GPa by utilizing evolutionary structure searches. TaH and TaH2 were found to be thermodynamically stable over this entire pressure range, whereas TaH3, TaH4, and TaH6 become thermodynamically stable at pressures greater than 50 GPa. The dense Pnma (TaH2), R3̅m (TaH4), and Fdd2 (TaH6) compounds possess metallic character with a strong ionic feature. For the highly hydrogen-rich phase of Fdd2 (TaH6), a calculation of electron-phonon coupling reveals the potential high-Tc superconductivity with an estimated value of 124.2-135.8 K.

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Zhuang Q. et al. Pressure-Stabilized Superconductive Ionic Tantalum Hydrides. // Inorganic Chemistry. 2017. Vol. 56. No. 7. pp. 3901-3908.

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Zhuang Q., Jin X., Cui T., Ma Y., Lv Q., Li Y., Zhang H., Meng X., Bao K. Pressure-Stabilized Superconductive Ionic Tantalum Hydrides. // Inorganic Chemistry. 2017. Vol. 56. No. 7. pp. 3901-3908.

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TY - JOUR

DO - 10.1021/acs.inorgchem.6b02822

UR - https://doi.org/10.1021/acs.inorgchem.6b02822

TI - Pressure-Stabilized Superconductive Ionic Tantalum Hydrides.

T2 - Inorganic Chemistry

AU - Zhuang, Quan

AU - Jin, Xilian

AU - Cui, Tian

AU - Ma, Yanbin

AU - Lv, Qianqian

AU - Li, Ying

AU - Zhang, Huadi

AU - Meng, Xing

AU - Bao, Kuo

PY - 2017

DA - 2017/03/16

PB - American Chemical Society (ACS)

SP - 3901-3908

IS - 7

VL - 56

PMID - 28300399

SN - 0020-1669

SN - 1520-510X

ER -

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@article{2017_Zhuang,

author = {Quan Zhuang and Xilian Jin and Tian Cui and Yanbin Ma and Qianqian Lv and Ying Li and Huadi Zhang and Xing Meng and Kuo Bao},

title = {Pressure-Stabilized Superconductive Ionic Tantalum Hydrides.},

journal = {Inorganic Chemistry},

year = {2017},

volume = {56},

publisher = {American Chemical Society (ACS)},

month = {mar},

url = {https://doi.org/10.1021/acs.inorgchem.6b02822},

number = {7},

pages = {3901--3908},

doi = {10.1021/acs.inorgchem.6b02822}

}

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Zhuang, Quan, et al. “Pressure-Stabilized Superconductive Ionic Tantalum Hydrides..” Inorganic Chemistry, vol. 56, no. 7, Mar. 2017, pp. 3901-3908. https://doi.org/10.1021/acs.inorgchem.6b02822.