Deliverables
EXTMOS Open Research Data Pilot
Link to T4 Communicate with, receive feedback from and engage in dialogue with (i) the public and users with a stake in societal and environmental impacts, (ii) commercial users and potential investors: device manufacturers and their supply chain and the simulation supply chain/software houses, (iii) research users Full description in part B
Link to T4 Communicate with, receive feedback from and engage in dialogue with (i) the public and users with a stake in societal and environmental impacts, (ii) commercial users and potential investors: device manufacturers and their supply chain and the simulation supply chain/software houses, (iii) research users, (iv) users requiring skills and educational training. all partners 09/18 Erice, Italy EXTMOS Summer School
Link to T4 Communicate with, receive feedback from and engage in dialogue with (i) the public and users with a stake in societal and environmental impacts, (ii) commercial users and potential investors: device manufacturers and their supply chain and the simulation supply chain/software houses, (iii) research users, (iv) users requiring skills and educational training. all partners
link to T4 Communicate with, receive feedback from and engage in dialogue with (i) the public and users with a stake in societal and environmental impacts, (ii) commercial users and potential investors: device manufacturers and their supply chain and the simulation supply chain/software houses, (iii) research users, (iv) users requiring skills and educational training. all partners
Link to T4 Communicate with, receive feedback from and engage in dialogue with (i) the public and users with a stake in societal and environmental impacts, (ii) commercial users and potential investors: device manufacturers and their supply chain and the simulation supply chain/software houses, (iii) research users, (iv) users requiring skills and educational training. all partners Online documentation to be tested at tutorial course 1 to be linked to a conference attended by potential users of EXTMOS model
Link to T4 Communicate with, receive feedback from and engage in dialogue with (i) the public and users with a stake in societal and environmental impacts, (ii) commercial users and potential investors: device manufacturers and their supply chain and the simulation supply chain/software houses, (iii) research users, (iv) users requiring skills and educational training. all partners M34 04/18 UBAH and US advisors satellite to MRS Spring conf, US
Linked to T4 Communicate with, receive feedback from and engage in dialogue with (i) the public and (ii) users with a stake in societal and environmental impacts. Full description in part b
Link to T4 Communicate with, receive feedback from and engage in dialogue with (ii) commercial users and potential investors: device manufacturers and their supply chain and the simulation supply chain/software houses, (iii) research users all partners Set up data repository with public access with preliminary collection of data needed by and output from EXTMOS package and validation measurements.
EXTMOS Modelling Data form, MODA
Searching for OpenAIRE data...
Publications
Author(s): Ivan Duchemin, Denis Jacquemin, Xavier Blase
Published in: The Journal of Chemical Physics, Issue 144/16, 2016, Page(s) 164106, ISSN 0021-9606
DOI: 10.1063/1.4946778
Author(s): Jing Li, Gabriele D’Avino, Ivan Duchemin, David Beljonne, Xavier Blase
Published in: The Journal of Physical Chemistry Letters, Issue 7/14, 2016, Page(s) 2814-2820, ISSN 1948-7185
DOI: 10.1021/acs.jpclett.6b01302
Author(s): Laura E. Ratcliff, Stephan Mohr, Georg Huhs, Thierry Deutsch, Michel Masella, Luigi Genovese
Published in: Wiley Interdisciplinary Reviews: Computational Molecular Science, Issue 7/1, 2017, Page(s) e1290, ISSN 1759-0876
DOI: 10.1002/wcms.1290
Author(s): Sai Manoj Gali, Claudio Quarti, Yoann Olivier, Jérôme Cornil, Lionel Truflandier, Frédéric Castet, Luca Muccioli, David Beljonne
Published in: Journal of Materials Chemistry C, Issue 7/15, 2019, Page(s) 4382-4391, ISSN 2050-7534
DOI: 10.1039/c8tc06385k
Author(s): Franz Symalla, Pascal Friederich, Andrea Massé, Velimir Meded, Reinder Coehoorn, Peter Bobbert, Wolfgang Wenzel
Published in: Physical Review Letters, Issue 117/27, 2016, Page(s) 276803, ISSN 0031-9007
DOI: 10.1103/physrevlett.117.276803
Author(s): Anton Pershin, David Hall, Vincent Lemaur, Juan-Carlos Sancho-Garcia, Luca Muccioli, Eli Zysman-Colman, David Beljonne, Yoann Olivier
Published in: Nature Communications, Issue 10/1, 2019, Page(s) 597, ISSN 2041-1723
DOI: 10.1038/s41467-019-08495-5
Author(s): Deepthi K. Mangalore, Paul W. M. Blom, Gert-Jan A. H. Wetzelaer
Published in: APL Materials, Issue 7/1, 2019, Page(s) 011105, ISSN 2166-532X
DOI: 10.1063/1.5058686
Author(s): Claudio Zannoni
Published in: Liquid Crystals, Issue 45/13-15, 2018, Page(s) 1880-1893, ISSN 0267-8292
DOI: 10.1080/02678292.2018.1512170
Author(s): Jing Li, Ivan Duchemin, Otello Maria Roscioni, Pascal Friederich, Marie Anderson, Enrico Da Como, Gabriele Kociok-Köhn, Wolfgang Wenzel, Claudio Zannoni, David Beljonne, Xavier Blase, Gabriele D'Avino
Published in: Materials Horizons, Issue 6/1, 2019, Page(s) 107-114, ISSN 2051-6347
DOI: 10.1039/c8mh00921j
Author(s): Denis Jacquemin, Ivan Duchemin, Xavier Blase
Published in: The Journal of Physical Chemistry Letters, Issue 8/7, 2017, Page(s) 1524-1529, ISSN 1948-7185
DOI: 10.1021/acs.jpclett.7b00381
Author(s): Xander de Vries, Pascal Friederich, Wolfgang Wenzel, Reinder Coehoorn, Peter A. Bobbert
Published in: Physical Review B, Issue 97/7, 2018, Page(s) 075203, ISSN 2469-9950
DOI: 10.1103/physrevb.97.075203
Author(s): Jing Li, Gabriele D'Avino, Anton Pershin, Denis Jacquemin, Ivan Duchemin, David Beljonne, Xavier Blase
Published in: Physical Review Materials, Issue 1/2, 2017, Page(s) 025602, ISSN 2475-9953
DOI: 10.1103/PhysRevMaterials.1.025602
Author(s): Feilong Liu, Andrea Massé, Pascal Friederich, Franz Symalla, Robert Nitsche, Wolfgang Wenzel, Reinder Coehoorn, Peter A. Bobbert
Published in: Applied Physics Letters, Issue 109/24, 2016, Page(s) 243301, ISSN 0003-6951
DOI: 10.1063/1.4971969
Author(s): Jing Li, Markus Holzmann, Ivan Duchemin, Xavier Blase, Valerio Olevano
Published in: Physical Review Letters, Issue 118/16, 2017, ISSN 0031-9007
DOI: 10.1103/PhysRevLett.118.163001
Author(s): Sachin R. Chaudhari, John M. Griffin, Katharina Broch, Anne Lesage, Vincent Lemaur, Dmytro Dudenko, Yoann Olivier, Henning Sirringhaus, Lyndon Emsley, Clare P. Grey
Published in: Chemical Science, Issue 8/4, 2017, Page(s) 3126-3136, ISSN 2041-6520
DOI: 10.1039/c7sc00053g
Author(s): Gabriele D’Avino, Luca Muccioli, Frédéric Castet, Carl Poelking, Denis Andrienko, Zoltán G Soos, Jérôme Cornil, David Beljonne
Published in: Journal of Physics: Condensed Matter, Issue 28/43, 2016, Page(s) 433002, ISSN 0953-8984
DOI: 10.1088/0953-8984/28/43/433002
Author(s): Ivan Duchemin, Jing Li, Xavier Blase
Published in: Journal of Chemical Theory and Computation, Issue 13/3, 2017, Page(s) 1199-1208, ISSN 1549-9618
DOI: 10.1021/acs.jctc.6b01215
Author(s): G. Fisicaro, L. Genovese, O. Andreussi, N. Marzari, S. Goedecker
Published in: The Journal of Chemical Physics, Issue 144/1, 2016, Page(s) 014103, ISSN 0021-9606
DOI: 10.1063/1.4939125
Author(s): Jing Li, Gabriele D'Avino, Ivan Duchemin, David Beljonne, Xavier Blase
Published in: Physical Review B, Issue 97/3, 2018, Page(s) 035108, ISSN 2469-9950
DOI: 10.1103/PhysRevB.97.035108
Author(s): Naresh B. Kotadiya, Hao Lu, Anirban Mondal, Yutaka Ie, Denis Andrienko, Paul W. M. Blom, Gert-Jan A. H. Wetzelaer
Published in: Nature Materials, Issue 17/4, 2018, Page(s) 329-334, ISSN 1476-1122
DOI: 10.1038/s41563-018-0022-8
Author(s): Ivan Duchemin, Ciro A. Guido, Denis Jacquemin, Xavier Blase
Published in: Chemical Science, Issue 9/19, 2018, Page(s) 4430-4443, ISSN 2041-6520
DOI: 10.1039/C8SC00529J
Author(s): J. X. Lian, A. Lherbier, L. J. Wang, J.-C. Charlier, D. Beljonne, Y. Olivier
Published in: The Journal of Physical Chemistry C, Issue 120/36, 2016, Page(s) 20024-20032, ISSN 1932-7447
DOI: 10.1021/acs.jpcc.6b06265
Author(s): Ian R. Thompson, Mary K. Coe, Alison B. Walker, Matteo Ricci, Otello M. Roscioni, Claudio Zannoni
Published in: Physical Review Materials, Issue 2/6, 2018, Page(s) 064601, ISSN 2475-9953
DOI: 10.1103/PhysRevMaterials.2.064601
Author(s): Nicola Castagnetti, Gabriele Kociok-Köhn, Enrico Da Como, Alberto Girlando
Published in: Physical Review B, Issue 95/2, 2017, Page(s) 024101, ISSN 2469-9950
DOI: 10.1103/PhysRevB.95.024101
Author(s): Stephan Mohr, Michel Masella, Laura E. Ratcliff, Luigi Genovese
Published in: Journal of Chemical Theory and Computation, Issue 13/9, 2017, Page(s) 4079-4088, ISSN 1549-9618
DOI: 10.1021/acs.jctc.7b00291
Author(s): Feilong Liu, Harm van Eersel, Bojian Xu, Janine G. E. Wilbers, Michel P. de Jong, Wilfred G. van der Wiel, Peter A. Bobbert, Reinder Coehoorn
Published in: Physical Review B, Issue 96/20, 2017, ISSN 2469-9950
DOI: 10.1103/physrevb.96.205203
Author(s): Y. Olivier, B. Yurash, L. Muccioli, G. D’Avino, O. Mikhnenko, J. C. Sancho-García, C. Adachi, T.-Q. Nguyen, D. Beljonne
Published in: Physical Review Materials, Issue 1/7, 2017, Page(s) 075602, ISSN 2475-9953
DOI: 10.1103/PhysRevMaterials.1.075602
Author(s): Ian R Thompson, Mary K Coe, Alison B Walker, Matteo Ricci, Otello M Roscioni, Claudio Zannoni
Published in: Liquid Crystals, Issue 45/13-15, 2018, Page(s) 2086-2096, ISSN 0267-8292
DOI: 10.1080/02678292.2018.1512666
Author(s): Sai Manoj Gali, Gabriele D’Avino, Philippe Aurel, Guangchao Han, Yuanping Yi, Theodoros A. Papadopoulos, Veaceslav Coropceanu, Jean-Luc Brédas, Georges Hadziioannou, Claudio Zannoni, Luca Muccioli
Published in: The Journal of Chemical Physics, Issue 147/13, 2017, Page(s) 134904, ISSN 0021-9606
DOI: 10.1063/1.4996969
Author(s): Christina Graham, Mónica Moral, Luca Muccioli, Yoann Olivier, Ángel J. Pérez-Jiménez, Juan-Carlos Sancho-García
Published in: International Journal of Quantum Chemistry, Issue 118/12, 2018, Page(s) e25562, ISSN 0020-7608
DOI: 10.1002/qua.25562
Author(s): Y. Olivier, J.-C. Sancho-Garcia, L. Muccioli, G. D’Avino, D. Beljonne
Published in: The Journal of Physical Chemistry Letters, Issue 9/20, 2018, Page(s) 6149-6163, ISSN 1948-7185
DOI: 10.1021/acs.jpclett.8b02327
Author(s): R. Rohloff, N. B. Kotadiya, N. I. Crăciun, P. W. M. Blom, G. A. H. Wetzelaer
Published in: Applied Physics Letters, Issue 110/7, 2017, Page(s) 073301, ISSN 0003-6951
DOI: 10.1063/1.4976205
Author(s): M. Anderson, C. Ramanan, C. Fontanesi, A. Frick, S. Surana, D. Cheyns, M. Furno, T. Keller, S. Allard, U. Scherf, D. Beljonne, G. D’Avino, E. von Hauff, E. Da Como
Published in: Physical Review Materials, Issue 1/5, 2017, ISSN 2475-9953
DOI: 10.1103/PhysRevMaterials.1.055604
Author(s): Katharina Broch, Deepak Venkateshvaran, Vincent Lemaur, Yoann Olivier, David Beljonne, Mateusz Zelazny, Iyad Nasrallah, David J. Harkin, Martin Statz, Riccardo Di Pietro, Auke Jisk Kronemeijer, Henning Sirringhaus
Published in: Advanced Electronic Materials, Issue 3/11, 2017, Page(s) 1700225, ISSN 2199-160X
DOI: 10.1002/aelm.201700225
Author(s): Andrea Massé, Pascal Friederich, Franz Symalla, Feilong Liu, Velimir Meded, Reinder Coehoorn, Wolfgang Wenzel, Peter A. Bobbert
Published in: Physical Review B, Issue 95/11, 2017, ISSN 2469-9950
DOI: 10.1103/PhysRevB.95.115204
Author(s): Pascal Friederich, Verónica Gómez, Christian Sprau, Velimir Meded, Timo Strunk, Michael Jenne, Andrea Magri, Franz Symalla, Alexander Colsmann, Mario Ruben, Wolfgang Wenzel
Published in: Advanced Materials, Issue 29/43, 2017, Page(s) 1703505, ISSN 0935-9648
DOI: 10.1002/adma.201703505
Author(s): Pascal Friederich, Reinder Coehoorn, Wolfgang Wenzel
Published in: Chemistry of Materials, Issue 29/21, 2017, Page(s) 9528-9535, ISSN 0897-4756
DOI: 10.1021/acs.chemmater.7b03742
Author(s): Tudor H. Thomas, David J. Harkin, Alexander J. Gillett, Vincent Lemaur, Mark Nikolka, Aditya Sadhanala, Johannes M. Richter, John Armitage, Hu Chen, Iain McCulloch, S. Matthew Menke, Yoann Olivier, David Beljonne, Henning Sirringhaus
Published in: Nature Communications, Issue 10/1, 2019, ISSN 2041-1723
DOI: 10.1038/s41467-019-10277-y
Author(s): Pascal Friederich, Artem Fediai, Simon Kaiser, Manuel Konrad, Nicole Jung, Wolfgang Wenzel
Published in: Advanced Materials, Issue 31/26, 2019, Page(s) 1808256, ISSN 0935-9648
DOI: 10.1002/adma.201808256
Author(s): Naresh B. Kotadiya, Anirban Mondal, Shiyun Xiong, Paul W. M. Blom, Denis Andrienko, Gert‐Jan A. H. Wetzelaer
Published in: Advanced Electronic Materials, Issue 4/12, 2018, Page(s) 1800366, ISSN 2199-160X
DOI: 10.1002/aelm.201800366
Author(s): Fengyu Zhang, Antoine Kahn
Published in: Advanced Functional Materials, Issue 28/1, 2018, Page(s) 1703780, ISSN 1616-301X
DOI: 10.1002/adfm.201703780
Author(s): Alexander R. Smith, Ian R. Thompson, Alison B. Walker
Published in: The Journal of Chemical Physics, Issue 150/16, 2019, Page(s) 164115, ISSN 0021-9606
DOI: 10.1063/1.5088895
Author(s): Elliot J. Taffet, Yoann Olivier, Frankie Lam, David Beljonne, Gregory D. Scholes
Published in: The Journal of Physical Chemistry Letters, Issue 9/7, 2018, Page(s) 1620-1626, ISSN 1948-7185
DOI: 10.1021/acs.jpclett.8b00503
Author(s): Vincent Lemaur, Jérôme Cornil, Roberto Lazzaroni, Henning Sirringhaus, David Beljonne, Yoann Olivier
Published in: Chemistry of Materials, Issue 31/17, 2018, Page(s) 6889-6899, ISSN 0897-4756
DOI: 10.1021/acs.chemmater.9b01286
Author(s): Artem Fediai, Franz Symalla, Pascal Friederich, Wolfgang Wenzel
Published in: Nature Communications, Issue 10/1, 2019, ISSN 2041-1723
DOI: 10.1038/s41467-019-12526-6
Author(s): Franz Symalla, Pascal Friederich, Simon Kaiser, Timo Strunk, Tobias Neumann, Wolfgang Wenzel
Published in: SID Symposium Digest of Technical Papers, Issue 49/1, 2018, Page(s) 340-342, ISSN 0097-966X
DOI: 10.1002/sdtp.12556
Author(s): Brett Yurash, Hajime Nakanotani, Yoann Olivier, David Beljonne, Chihaya Adachi, Thuc‐Quyen Nguyen
Published in: Advanced Materials, Issue 31/21, 2019, Page(s) 1804490, ISSN 0935-9648
DOI: 10.1002/adma.201804490
Author(s): Emrys W. Evans, Yoann Olivier, Yuttapoom Puttisong, William K. Myers, Timothy J. H. Hele, S. Matthew Menke, Tudor H. Thomas, Dan Credgington, David Beljonne, Richard H. Friend, Neil C. Greenham
Published in: The Journal of Physical Chemistry Letters, Issue 9/14, 2018, Page(s) 4053-4058, ISSN 1948-7185
DOI: 10.1021/acs.jpclett.8b01556
Author(s): Xander de Vries, Pascal Friederich, Wolfgang Wenzel, Reinder Coehoorn, Peter A. Bobbert
Published in: Physical Review B, Issue 99/20, 2019, ISSN 2469-9950
DOI: 10.1103/PhysRevB.99.205201
Author(s): Naresh B. Kotadiya, Paul W. M. Blom, Gert-Jan A. H. Wetzelaer
Published in: Nature Photonics, 2019, ISSN 1749-4885
DOI: 10.1038/s41566-019-0488-1
Author(s): Pascal Friederich, Vadim Rodin, Florian von Wrochem, Wolfgang Wenzel
Published in: ACS Applied Materials & Interfaces, Issue 10/2, 2018, Page(s) 1881-1887, ISSN 1944-8244
DOI: 10.1021/acsami.7b11762
Author(s): N.B. Kotadiya, P.W.M. Blom, G.A.H. Wetzelaer
Published in: Physical Review Applied, Issue 11/2, 2019, ISSN 2331-7019
DOI: 10.1103/physrevapplied.11.024069
Author(s): Saeed-Uz-Zaman Khan, Giacomo Londi, Xiao Liu, Michael A. Fusella, Gabriele D’Avino, Luca Muccioli, Alyssa N. Brigeman, Bjoern Niesen, Terry Chien-Jen Yang, Yoann Olivier, Jordan T. Dull, Noel C. Giebink, David Beljonne, Barry P. Rand
Published in: Chemistry of Materials, Issue 31/17, 2018, Page(s) 6808-6817, ISSN 0897-4756
DOI: 10.1021/acs.chemmater.9b01279
Author(s): Franz Symalla, Shahriar Heidrich, Maximilian Kubillus, Timo Strunk, Tobias Neumann, Wolfgang Wenzel
Published in: SID Symposium Digest of Technical Papers, Issue 50/1, 2019, Page(s) 259-262, ISSN 0097-966X
DOI: 10.1002/sdtp.12905
Author(s): Pascal Friederich, Artem Fediai, Jing Li, Anirban Mondal, Naresh Kotadiya, Gabriele D'Avino, Franz Symalla, Gert-Jan Wetzelaer, Denis Andrienko, David Beljonne, Paul Blom, Jean-Luc Brédas, Wolfgang Wenzel
Published in: 2019
Author(s): William Robert Saunders, James Grant, Eike Hermann Müller, Ian Thompson
Published in: 2019
Author(s): Marc-Antoine Stoeckel, Yoann Olivier, Marco Gobbi, Dmytro Dudenko, Vincent Lemaur, Mohamed Zbiri, Anne Y. Guilbert, Gabriele DAvino, Fabiola Liscio, Nicola Demitri, Xin Jin, Young-Gyun Jeong, Marco Vittorio Nardi, Luca Pasquali, Luca Razzari, David Beljonne, Paolo Samori, Emanuele Orgiu
Published in: 2019