Content available in repository
Content available in repository
Groene Loper 19, Flux
5612 AP Eindhoven
Netherlands
P.O. Box 513, Flux
5600 MB Eindhoven
Netherlands
We use simulation to design multifunctional materials and optimize processes related to renewables and energy efficiency
INVENTING MATERIALS TO MEET TODAY'S ENERGY AND ENVIRONMENTAL CHALLENGES
The Materials Simulation & Modelling Group (MSM) in the Department of Applied Physics uses high-performance computers to simulate materials that potentially revolutionize renewable energy and green technology. We develop and apply both quantum and classical methods, together covering a comprehensive multiscale approach to studying materials and complex molecules from the atomistic scale to the nanoscale. Systems we currently focusing on include, but are not limited to, porous materials, novel semiconductors and hybrid nanomaterials. These are exciting materials that have a lot to offer. However, to establish unique relations between chemical composition, physical properties and their functionalities in the final application is still a chimera. Our motivation is to use theoretical analysis and computer modelling to “invent” materials that meet the current energy and environmental challenges of our society.
Person: Prom. : doctoral candidate (PhD), Prom. : doctoral candidate (PhD)
Person: UD : Assistant Professor, UD : Assistant Professor
Research output: Thesis › Phd Thesis 1 (Research TU/e / Graduation TU/e)
Research output: Contribution to journal › Article › Academic › peer-review
Research output: Contribution to journal › Article › Academic › peer-review
Zhao, H. (Contributor), Wang, Q. (Contributor), Wen, Z. (Contributor), Sun, H. (Contributor), Ji, S. (Contributor), Meng, X. (Contributor), Zhang, R. (Contributor), Jiang, J. (Contributor), Tang, Z. (Contributor) & Liu, F. (Contributor), Cambridge Crystallographic Data Centre, 14 Nov 2023
DOI: 10.5517/ccdc.csd.cc2hgckx, http://www.ccdc.cam.ac.uk/services/structure_request?id=doi:10.5517/ccdc.csd.cc2hgckx&sid=DataCite
Dataset
Ji, S. (Contributor), Liu, Y. (Contributor), Wang, Y. (Contributor), Zhao, H. (Contributor), Wang, Q. (Contributor), Meng, Q. (Contributor), Bai, Y. (Contributor), Jiang, J. (Contributor), Shen, Q. (Contributor) & Liu, F. (Contributor), Cambridge Crystallographic Data Centre, 18 Apr 2023
DOI: 10.5517/ccdc.csd.cc2frlxq, http://www.ccdc.cam.ac.uk/services/structure_request?id=doi:10.5517/ccdc.csd.cc2frlxq&sid=DataCite
Dataset
Brocks, G. (Creator), Liang, Q. (Creator), Bieberle, A. (Contributor) & Sinha, V. (Contributor), 4TU.Centre for Research Data, 3 Jun 2021
DOI: 10.4121/14710647
Dataset
Pols, M. C. W. M. (Recipient), 2021
Prize: Other › Career, activity or publication related prizes (lifetime, best paper, poster etc.) › Scientific
Zhakisheva, B. (Recipient), 31 May 2018
Prize: Other › Scholarships › Scientific
Wasik, D. O. (Participant)
Activity: Participating in or organising an event types › Conference › Scientific
Apergi, S. (Speaker)
Activity: Talk or presentation types › Contributed talk › Scientific
Wasik, D. O. (Chair)
Activity: Participating in or organising an event types › Conference › Scientific
Creatore, M., Tao, S., Brocks, G. H. L. A. & Bracesco, A.
25/08/23
1 item of Media coverage
Press/Media: Expert Comment
7/10/22
1 item of Media coverage
Press/Media: Expert Comment
Loerakker, S., van Berkel, M., Tao, S., Bosco, E., Fitzgerald, B., van der Meel, R. & Abiad Monge, A.
4/07/22
2 items of Media coverage
Press/Media: Expert Comment
Student thesis: Bachelor
Student thesis: Master
Student thesis: Master