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Atomic and Electronic Structure in MgO–SiO<sub>2</sub>

Description/Abstract:

Understanding disordered structure is difficult due to insufficient information in experimental data. Here we overcome this issue by usin...

Keyword:

Glass, Neutron diffraction, Structure, and X-ray diffraction

Resource Type:

Article

Author:

Yuta Shuseki, Shinji Kohara, Tomoaki Kaneko, Keitaro Sodeyama, Yohei Onodera, Chihiro Koyama, Atsunobu Masuno, Shunta Sasaki, Shohei Hatano, Motoki Shiga, Ippei Obayashi, Yasuaki Hiraoka, Junpei T. Okada, Akitoshi Mizuno, Yuki Watanabe, Yui Nakata, Koji Ohara, Motohiko Murakami, Matthew G. Tucker, Marshall T. McDonnell, Hirohisa Oda, and Takehiko Ishikawa

Journal:

The Journal of Physical Chemistry A

Date Uploaded:

01/04/2024
First-principles study of the reconstruction of MgM2O4 (M = Mn, Fe, Co) spinel surface

Description/Abstract:

MgM2O4 (M = Mn, Fe, Co) spinels, which transform into rock-salt phases on Mg incorporation, are attractive cathode materials for future M...

Keyword:

Cathode, First-principles calculations, Mg-battery, Spinel Surface, and Surface reconstruction

Resource Type:

Article

Author:

Tomoaki Kaneko, Yui Fujihara, Hiroaki Kobayashi, and Keitaro Sodeyama

Date Uploaded:

01/02/2023

Date Modified:

20/03/2024