Zhang, Chao http://orcid.org/0000-0002-7167-0840
Cheng, Jun http://orcid.org/0000-0001-6971-0797
Chen, Yiming http://orcid.org/0000-0002-1501-5550
Chan, Maria K Y http://orcid.org/0000-0003-0922-1363
Cai, Qiong http://orcid.org/0000-0002-1677-0515
Carvalho, Rodrigo P http://orcid.org/0000-0003-3895-6529
Marchiori, Cleber F N http://orcid.org/0000-0003-0377-3669
Brandell, Daniel http://orcid.org/0000-0002-8019-2801
Araujo, C Moyses http://orcid.org/0000-0001-5192-0016
Chen, Ming
Ji, Xiangyu
Feng, Guang http://orcid.org/0000-0001-6659-9181
Goloviznina, Kateryna http://orcid.org/0000-0001-9913-4938
Serva, Alessandra http://orcid.org/0000-0002-7525-2494
Salanne, Mathieu http://orcid.org/0000-0002-1753-491X
Mandai, Toshihiko http://orcid.org/0000-0002-2403-7794
Hosaka, Tomooki
Alhanash, Mirna
Johansson, Patrik http://orcid.org/0000-0002-9907-117X
Qiu, Yun-Ze
Xiao, Hai http://orcid.org/0000-0001-9399-1584
Eikerling, Michael
Jinnouchi, Ryosuke http://orcid.org/0000-0002-0822-1161
Melander, Marko M
Kastlunger, Georg
Bouzid, Assil http://orcid.org/0000-0002-9363-7240
Pasquarello, Alfredo http://orcid.org/0000-0002-9142-2799
Shin, Seung-Jae
Kim, Minho M http://orcid.org/0000-0002-3960-8908
Kim, Hyungjun
Schwarz, Kathleen http://orcid.org/0000-0002-1539-4511
Sundararaman, Ravishankar http://orcid.org/0000-0002-0625-4592
Funding for this research was provided by:
Labex
French National Research Agency
Sweden’s Innovation Agency
STORE-EX (ANR-10-LABX-0076)
Research Program
HGF
GPAW
Academy of Finland (338228)
National Key Research and Development Project (2022YFA1503000)
KAKENHI (22K14772)
Initiative Scientific Research Program (20221080065)
Tsinghua University
Frontier Youth Team
Program for HUST Academic
European Union (771294)
China Postdoctoral Science Foundation (2022T150228)
Faraday Institution (EP/S003053/1)
National Natural Science Foundation of China (21861132015)
Swedish Research Council (2018-04506)
OPERA (101103834)
BES
AI
Knut and Alice Wallenberg Foundation
European Research Council (949012)
Samsung
DOE, Office of Basic Energy Sciences (DE-AC02-06CH11357)
the U.S. Department of Energy, Office of Science, Basic Energy Sciences (DE-SC0022247)
Science and Technology Foundation
Early Career award
Swedish Energy Agency (45420-1)
U.S. Department of Energy Office of Science User Facility
Center for Nanoscale Materials
Office of Science
U.S. Department of Energy
Japan Science and Technology Agency (21K05263)
NEXT Center of Innovation (JPMJPF2016)
JSPS
Japan Society for the Promotion of Science
Article Title: 2023 Roadmap on molecular modelling of electrochemical energy materials
Journal Title: Journal of Physics: Energy
Article Type: paper
Copyright Information: © 2023 The Author(s). Published by IOP Publishing Ltd
Publication dates
Date Received: 2023-04-19
Date Accepted: 2023-09-29
Online publication date: 2023-10-30