, том 124 , издание 3 , страницы 2070-2078

First-Principles and Microkinetic Study on the Mechanism for Ammonia Synthesis Using Ru-Loaded Hydride Catalyst

Takuya Nakao ¹

Tomofumi Tada ¹

Hideo Hosono ¹

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Materials Research Center for Element Strategy, Tokyo Institute of Technology, 4259 Nagatsuta, Midori-ku, Yokohama 226-8503, Japan |

Тип публикации: Journal Article

Дата публикации: 2019-12-30

American Chemical Society (ACS)

Journal of Physical Chemistry C

scimago Q1

wos Q3

БС1

SJR: 0.914

CiteScore: 6.2

Impact factor: 3.2

ISSN: 19327447, 19327455

DOI: 10.1021/acs.jpcc.9b10850

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Surfaces, Coatings and Films

Electronic, Optical and Magnetic Materials

Physical and Theoretical Chemistry

General Energy

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Ru-loaded hydride is an efficient catalyst for ammonia (NH3) synthesis under mild conditions. Metal hydrides such as Ca2NH with surface anionic electrons at hydrogen vacancies (Ca2NH1–xex–) functio...

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Nakao T., Tada T., Hosono H. First-Principles and Microkinetic Study on the Mechanism for Ammonia Synthesis Using Ru-Loaded Hydride Catalyst // Journal of Physical Chemistry C. 2019. Vol. 124. No. 3. pp. 2070-2078.

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TY - JOUR

DO - 10.1021/acs.jpcc.9b10850

UR - https://doi.org/10.1021/acs.jpcc.9b10850

TI - First-Principles and Microkinetic Study on the Mechanism for Ammonia Synthesis Using Ru-Loaded Hydride Catalyst

T2 - Journal of Physical Chemistry C

AU - Nakao, Takuya

AU - Tada, Tomofumi

AU - Hosono, Hideo

PY - 2019

DA - 2019/12/30

PB - American Chemical Society (ACS)

SP - 2070-2078

IS - 3

VL - 124

SN - 1932-7447

SN - 1932-7455

ER -

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@article{2019_Nakao,

author = {Takuya Nakao and Tomofumi Tada and Hideo Hosono},

title = {First-Principles and Microkinetic Study on the Mechanism for Ammonia Synthesis Using Ru-Loaded Hydride Catalyst},

journal = {Journal of Physical Chemistry C},

year = {2019},

volume = {124},

publisher = {American Chemical Society (ACS)},

month = {dec},

url = {https://doi.org/10.1021/acs.jpcc.9b10850},

number = {3},

pages = {2070--2078},

doi = {10.1021/acs.jpcc.9b10850}

}

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Nakao, Takuya, et al. “First-Principles and Microkinetic Study on the Mechanism for Ammonia Synthesis Using Ru-Loaded Hydride Catalyst.” Journal of Physical Chemistry C, vol. 124, no. 3, Dec. 2019, pp. 2070-2078. https://doi.org/10.1021/acs.jpcc.9b10850.