Roadmap on methods and software for electronic structure based simulations in chemistry and materials

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Roadmap on methods and software for electronic structure based simulations in chemistry and materials

Year of publication

2024

Authors

Blum, Volker; Asahi, Ryoji; Autschbach, Jochen; Bannwarth, Christoph; Bihlmayer, Gustav; Bluegel, Stefan; Burns, Lori A.; Crawford, T. Daniel; Dawson, William; de Jong, Wibe Albert; Draxl, Claudia; Filippi, Claudia; Genovese, Luigi; Giannozzi, Paolo; Govind, Niranjan; Hammes-Schiffer, Sharon; Hammond, Jeff R.; Hourahine, Benjamin; Jain, Anubhav; Kanai, Yosuke
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Organizations and authors

University of Helsinki

Lehtola Susi

Publication type

Publication format

Article

Parent publication type

Journal

Article type

Original article

Audience

Scientific

Peer-reviewed

Peer-Reviewed

MINEDU's publication type classification code

A1 Journal article (refereed), original research

Publication channel information

Journal

Electronic structure

Parent publication name

Electronic structure

Volume

6

Issue

4

Article number

042501

ISSN

2516-1075

​Publication forum

90859

​Publication forum level

1

Open access

Open access in the publisher’s service

Yes

Open access of publication channel

Partially open publication channel

License of the publisher’s version

CC BY

Self-archived

Yes

License of the self-archived publication

CC BY

Other information

Fields of science

Chemical sciences

Publication country

United Kingdom

Internationality of the publisher

International

Language

English

International co-publication

Yes

Co-publication with a company

No

DOI

10.1088/2516-1075/ad48ec

The publication is included in the Ministry of Education and Culture’s Publication data collection

Yes