Active discovery of organic semiconductors

Existing methods for organic semiconductor computational screening are limited by the computational demand of the process, leading to the identification of non-optimal material candidates. Here, the authors report machine learning method to guide the discovery of organic semiconductors.

Guardado en:

Detalles Bibliográficos
Autores principales:	Christian Kunkel, Johannes T. Margraf, Ke Chen, Harald Oberhofer, Karsten Reuter
Formato:	article
Lenguaje:	EN
Publicado:	Nature Portfolio 2021
Materias:	Science Q
Acceso en línea:	https://doaj.org/article/17214865234d479bbb2f2a156defa811
Etiquetas:	Agregar Etiqueta Sin Etiquetas, Sea el primero en etiquetar este registro!

id	oai:doaj.org-article:17214865234d479bbb2f2a156defa811
record_format	dspace
spelling	oai:doaj.org-article:17214865234d479bbb2f2a156defa8112021-12-02T13:39:46ZActive discovery of organic semiconductors10.1038/s41467-021-22611-42041-1723https://doaj.org/article/17214865234d479bbb2f2a156defa8112021-04-01T00:00:00Zhttps://doi.org/10.1038/s41467-021-22611-4https://doaj.org/toc/2041-1723Existing methods for organic semiconductor computational screening are limited by the computational demand of the process, leading to the identification of non-optimal material candidates. Here, the authors report machine learning method to guide the discovery of organic semiconductors.Christian KunkelJohannes T. MargrafKe ChenHarald OberhoferKarsten ReuterNature PortfolioarticleScienceQENNature Communications, Vol 12, Iss 1, Pp 1-11 (2021)
institution	DOAJ
collection	DOAJ
language	EN
topic	Science Q
spellingShingle	Science Q Christian Kunkel Johannes T. Margraf Ke Chen Harald Oberhofer Karsten Reuter Active discovery of organic semiconductors
description	Existing methods for organic semiconductor computational screening are limited by the computational demand of the process, leading to the identification of non-optimal material candidates. Here, the authors report machine learning method to guide the discovery of organic semiconductors.
format	article
author	Christian Kunkel Johannes T. Margraf Ke Chen Harald Oberhofer Karsten Reuter
author_facet	Christian Kunkel Johannes T. Margraf Ke Chen Harald Oberhofer Karsten Reuter
author_sort	Christian Kunkel
title	Active discovery of organic semiconductors
title_short	Active discovery of organic semiconductors
title_full	Active discovery of organic semiconductors
title_fullStr	Active discovery of organic semiconductors
title_full_unstemmed	Active discovery of organic semiconductors
title_sort	active discovery of organic semiconductors
publisher	Nature Portfolio
publishDate	2021
url	https://doaj.org/article/17214865234d479bbb2f2a156defa811
work_keys_str_mv	AT christiankunkel activediscoveryoforganicsemiconductors AT johannestmargraf activediscoveryoforganicsemiconductors AT kechen activediscoveryoforganicsemiconductors AT haraldoberhofer activediscoveryoforganicsemiconductors AT karstenreuter activediscoveryoforganicsemiconductors
_version_	1718392600433524736

Active discovery of organic semiconductors

Ejemplares similares