Chemical stability of hydrogen boride nanosheets in water
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{
"updated": "2021-07-23T14:32:13.878238+00:00",
"id": "893",
"metadata": {
"id": "893",
"status": "published",
"_files": [
{
"description": "Collection of crystal structures",
"size": 52173,
"key": "crystal_structure.zip",
"checksum": "md5:8b62bdcd278a214d449176d6a6e40945"
},
{
"description": "Collection of input files to reproduce results",
"size": 11243,
"key": "calculations.zip",
"checksum": "md5:831992eda9e980ca1f87e87b96af3f33"
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{
"description": "Detailed information about the archive crystal_structure.zip and calculations.zip",
"size": 2726,
"key": "README.txt",
"checksum": "md5:2473a5150508be6fb666088253713378"
}
],
"contributors": [
{
"givennames": "Kurt Irvin",
"familyname": "Rojas",
"affiliations": [
"Physics Department, College of Science, De La Salle University, Manila 1004, Philippines.",
"Department of Precision Engineering, Graduate School of Engineering, Osaka University, 2-1 Yamada-oka, Suita, Osaka 565-0871, Japan."
]
},
{
"givennames": "Nguyen Thanh",
"familyname": "Cuong",
"affiliations": [
"Faculty of Pure and Applied Sciences and Tsukuba Research Center for Energy Materials Science (TREMS), University of Tsukuba, Tsukuba, Ibaraki, 305-8573, Japan."
]
},
{
"givennames": "Hiroaki",
"familyname": "Nishino",
"affiliations": [
"Graduate school of Pure and Applied Sciences, University of Tsukuba, Tsukuba, Ibaraki, 305-8573, Japan."
]
},
{
"givennames": "Ryota",
"familyname": "Ishibiki",
"affiliations": [
"Graduate school of Pure and Applied Sciences, University of Tsukuba, Tsukuba, Ibaraki, 305-8573, Japan."
]
},
{
"givennames": "Shin-ichi",
"familyname": "Ito",
"affiliations": [
"Faculty of Pure and Applied Sciences and Tsukuba Research Center for Energy Materials Science (TREMS), University of Tsukuba, Tsukuba, Ibaraki, 305-8573, Japan.",
"Materials Research Center for Element Strategy, Tokyo Institute of Technology, Yokohama 226-8503, Japan."
]
},
{
"givennames": "Masahiro",
"familyname": "Miyauchi",
"affiliations": [
"Department of Materials Science and Engineering, School of Materials and Chemical Technology, Tokyo Institute of Technology, 2-12-1, Ookayama, Meguro-ku, Tokyo 152-8552, Japan."
]
},
{
"givennames": "Yoshitaka",
"familyname": "Fujimoto",
"affiliations": [
"Department of Physics, Tokyo Institute of Technology, Tokyo 152-8551, Japan."
]
},
{
"givennames": "Satoshi",
"familyname": "Tominaka",
"affiliations": [
"International Center for Materials Nanoarchitectonics, National Institute for Materials Science, Tsukuba, Ibaraki 305-0044, Japan."
]
},
{
"givennames": "Susumu",
"familyname": "Okada",
"affiliations": [
"Faculty of Pure and Applied Sciences and Tsukuba Research Center for Energy Materials Science (TREMS), University of Tsukuba, Tsukuba, Ibaraki, 305-8573, Japan."
]
},
{
"givennames": "Hideo",
"familyname": "Hosono",
"affiliations": [
"Materials Research Center for Element Strategy, Tokyo Institute of Technology, Yokohama 226-8503, Japan.",
"International Center for Materials Nanoarchitectonics, National Institute for Materials Science, Tsukuba, Ibaraki 305-0044, Japan."
]
},
{
"givennames": "Nelson Jr.,",
"familyname": "Arboleda",
"affiliations": [
"Physics Department, College of Science, De La Salle University, Manila 1004, Philippines.",
"Advance Nanomaterials Investigations by Molecular Simulations (ANIMoS) Research Unit, Center for Natural Sciences and Environmental Research (CENSER), De La Salle University, Manila 1004, Philippines."
]
},
{
"givennames": "Takahiro",
"familyname": "Kondo",
"affiliations": [
"Faculty of Pure and Applied Sciences and Tsukuba Research Center for Energy Materials Science (TREMS), University of Tsukuba, Tsukuba, Ibaraki, 305-8573, Japan.",
"Materials Research Center for Element Strategy, Tokyo Institute of Technology, Yokohama 226-8503, Japan."
]
},
{
"givennames": "Yoshitada",
"familyname": "Morikawa",
"affiliations": [
"Department of Precision Engineering, Graduate School of Engineering, Osaka University, 2-1 Yamada-oka, Suita, Osaka 565-0871, Japan.",
"Element Strategy Initiative for Catalyst and Batteries, Kyoto University, Goryo-Ohara, Nishikyo-ku, Kyoto 615-8245, Japan.",
"Research Center for Precision Engineering, Graduate School of Engineering, Osaka University, 2-1 Yama-da-Oka, Suita, Osaka 565-0871, Japan."
]
},
{
"givennames": "Ikutaro",
"familyname": "Hamada",
"affiliations": [
"Department of Precision Engineering, Graduate School of Engineering, Osaka University, 2-1 Yamada-oka, Suita, Osaka 565-0871, Japan.",
"Research Center for Precision Engineering, Graduate School of Engineering, Osaka University, 2-1 Yama-da-Oka, Suita, Osaka 565-0871, Japan."
],
"email": "ihamada@prec.eng.osaka-u.ac.jp"
}
],
"conceptrecid": "892",
"doi": "10.24435/materialscloud:40-28",
"references": [
{
"url": "https://www.nature.com/articles/s43246-021-00184-5",
"citation": "K. I. M. Rojas, N. T. Cuong, H. Nishino, R. Ishibiki, S.-I. Ito, M. Miyauchi, Y. Fujimoto, S. Tominaka, S. Okada, H. Hosono, N. B. Arboleda Jr., T. Kondo, Y. Morikawa, I. Hamada, Commun Mater 2, 81 (2021)",
"comment": "Paper in which the data is discussed.",
"type": "Journal reference",
"doi": "10.1038/s43246-021-00184-5"
}
],
"title": "Chemical stability of hydrogen boride nanosheets in water",
"publication_date": "Jun 19, 2021, 16:30:57",
"description": "Hydrogen boride sheet is a recently fabricated boron-based two-dimensional nanosheet. For the interest of using it in electronic and catalytic applications, it is important that it has sufficient chemical stability for common substances. In this case, we investigate its chemical stability in water, a common substance in ambient condition and many applications. The study was done using experimental and first-principles method. This record contains the crystal structures, optimized via first-principles calculations that were used in discussing the various properties and interaction between water and hydrogen boride sheet. Additionally, input files used to calculate for the systems were included to aid in reproducing results of the study.",
"mcid": "2021.87",
"edited_by": 431,
"version": 1,
"is_last": true,
"owner": 431,
"license_addendum": null,
"keywords": [
"hydrogen boride",
"two-dimensional",
"nanosheet",
"DFT",
"density-functional theory",
"Chemical stability"
],
"_oai": {
"id": "oai:materialscloud.org:893"
},
"license": "Creative Commons Attribution 4.0 International"
},
"revision": 8,
"created": "2021-06-17T10:48:59.279627+00:00"
}