Identification and design principles of low hole effective mass p-type transparent conducting oxides
The development of high-performance transparent conducting oxides is critical to many technologies from transparent electronics to solar cells. Whereas n-type transparent conducting oxides are present in many devices, their p-type counterparts are not largely commercialized, as they exhibit much low...
| 主要な著者: | , , , , |
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| その他の著者: | |
| フォーマット: | 論文 |
| 言語: | en_US |
| 出版事項: |
Nature Publishing Group
2013
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| オンライン･アクセス: | http://hdl.handle.net/1721.1/82576 |
| _version_ | 1826191981643038720 |
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| author | Hautier, Geoffroy Miglio, Anna Ceder, Gerbrand Rignanese, Gian-Marco Gonze, Xavier |
| author2 | Massachusetts Institute of Technology. Department of Materials Science and Engineering |
| author_facet | Massachusetts Institute of Technology. Department of Materials Science and Engineering Hautier, Geoffroy Miglio, Anna Ceder, Gerbrand Rignanese, Gian-Marco Gonze, Xavier |
| author_sort | Hautier, Geoffroy |
| collection | MIT |
| description | The development of high-performance transparent conducting oxides is critical to many technologies from transparent electronics to solar cells. Whereas n-type transparent conducting oxides are present in many devices, their p-type counterparts are not largely commercialized, as they exhibit much lower carrier mobilities due to the large hole effective masses of most oxides. Here we conduct a high-throughput computational search on thousands of binary and ternary oxides and identify several highly promising compounds displaying exceptionally low hole effective masses (up to an order of magnitude lower than state-of-the-art p-type transparent conducting oxides), as well as wide band gaps. In addition to the discovery of specific compounds, the chemical rationalization of our findings opens new directions, beyond current Cu-based chemistries, for the design and development of future p-type transparent conducting oxides. |
| first_indexed | 2024-09-23T09:04:21Z |
| format | Article |
| id | mit-1721.1/82576 |
| institution | Massachusetts Institute of Technology |
| language | en_US |
| last_indexed | 2024-09-23T09:04:21Z |
| publishDate | 2013 |
| publisher | Nature Publishing Group |
| record_format | dspace |
| spelling | mit-1721.1/825762022-09-26T10:14:14Z Identification and design principles of low hole effective mass p-type transparent conducting oxides Hautier, Geoffroy Miglio, Anna Ceder, Gerbrand Rignanese, Gian-Marco Gonze, Xavier Massachusetts Institute of Technology. Department of Materials Science and Engineering Ceder, Gerbrand The development of high-performance transparent conducting oxides is critical to many technologies from transparent electronics to solar cells. Whereas n-type transparent conducting oxides are present in many devices, their p-type counterparts are not largely commercialized, as they exhibit much lower carrier mobilities due to the large hole effective masses of most oxides. Here we conduct a high-throughput computational search on thousands of binary and ternary oxides and identify several highly promising compounds displaying exceptionally low hole effective masses (up to an order of magnitude lower than state-of-the-art p-type transparent conducting oxides), as well as wide band gaps. In addition to the discovery of specific compounds, the chemical rationalization of our findings opens new directions, beyond current Cu-based chemistries, for the design and development of future p-type transparent conducting oxides. United States. Office of Naval Research (Award N00014-11-1-0212) 2013-11-25T17:50:12Z 2013-11-25T17:50:12Z 2013-08 2012-12 Article http://purl.org/eprint/type/JournalArticle 2041-1723 http://hdl.handle.net/1721.1/82576 Hautier, Geoffroy, Anna Miglio, Gerbrand Ceder, Gian-Marco Rignanese, and Xavier Gonze. “Identification and design principles of low hole effective mass p-type transparent conducting oxides.” Nature Communications 4 (August 13, 2013). © 2013 Nature Publishing Group, a division of Macmillan Publishers Limited en_US http://dx.doi.org/10.1038/ncomms3292 Nature Communications http://creativecommons.org/licenses/by-nc-sa/3.0/ application/pdf Nature Publishing Group PMC |
| spellingShingle | Hautier, Geoffroy Miglio, Anna Ceder, Gerbrand Rignanese, Gian-Marco Gonze, Xavier Identification and design principles of low hole effective mass p-type transparent conducting oxides |
| title | Identification and design principles of low hole effective mass p-type transparent conducting oxides |
| title_full | Identification and design principles of low hole effective mass p-type transparent conducting oxides |
| title_fullStr | Identification and design principles of low hole effective mass p-type transparent conducting oxides |
| title_full_unstemmed | Identification and design principles of low hole effective mass p-type transparent conducting oxides |
| title_short | Identification and design principles of low hole effective mass p-type transparent conducting oxides |
| title_sort | identification and design principles of low hole effective mass p type transparent conducting oxides |
| url | http://hdl.handle.net/1721.1/82576 |
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