Volker Deringer
@vlderinger.bsky.social
Computational chemist, curious about the atomic-scale structure of materials & ML for chemistry. Professor of Materials Chemistry at the University of Oxford
Mechanical properties of graphene oxide from machine-learning-driven simulations – now online in ChemComm (@chemcomm.rsc.org)! In this #compchem study, we explore the links between atomistic structure and mechanical behaviour in GO. Congratulations Zak & Bowen 🙂
Read more: doi.org/10.1039/D5CC...
Read more: doi.org/10.1039/D5CC...
June 27, 2025 at 3:56 PM
Mechanical properties of graphene oxide from machine-learning-driven simulations – now online in ChemComm (@chemcomm.rsc.org)! In this #compchem study, we explore the links between atomistic structure and mechanical behaviour in GO. Congratulations Zak & Bowen 🙂
Read more: doi.org/10.1039/D5CC...
Read more: doi.org/10.1039/D5CC...
Congratulations to the group‘s MChem students Georgi, Arun, Johana, and Cecilia on completing their projects & theses! They covered a range of topics across #compchem, ML, and materials chemistry applications – well done and thank you everyone 😀
June 19, 2025 at 12:58 PM
Congratulations to the group‘s MChem students Georgi, Arun, Johana, and Cecilia on completing their projects & theses! They covered a range of topics across #compchem, ML, and materials chemistry applications – well done and thank you everyone 😀
It was great to take part in the @cecamevents.bsky.social Flagship Workshop on “Virtual Materials Design” at @kit.edu this week – and to see Litong, Shixuan, Natascia, & @biancapasca.bsky.social present their #compchem research! 😀
June 4, 2025 at 2:09 PM
It was great to take part in the @cecamevents.bsky.social Flagship Workshop on “Virtual Materials Design” at @kit.edu this week – and to see Litong, Shixuan, Natascia, & @biancapasca.bsky.social present their #compchem research! 😀
In Vancouver for a major conference on ceramic & glass technology! Looking forward to presenting some of our recent #compchem work, and to discussing what ML interatomic potentials can do in this exciting area 🙂
ceramics.org/event/16th-p...
ceramics.org/event/16th-p...
May 5, 2025 at 12:56 AM
In Vancouver for a major conference on ceramic & glass technology! Looking forward to presenting some of our recent #compchem work, and to discussing what ML interatomic potentials can do in this exciting area 🙂
ceramics.org/event/16th-p...
ceramics.org/event/16th-p...
In Cambridge today for a workshop on ML interatomic potentials! Photo with @jla-gardner.bsky.social, Natascia, @biancapasca.bsky.social, & Litong 🙂 #compchem
January 20, 2025 at 12:57 PM
In Cambridge today for a workshop on ML interatomic potentials! Photo with @jla-gardner.bsky.social, Natascia, @biancapasca.bsky.social, & Litong 🙂 #compchem
Wintry views by the Thames earlier today ❄️🙂
January 11, 2025 at 5:06 PM
Wintry views by the Thames earlier today ❄️🙂
Join us next year for an RSC Faraday Discussions meeting on "data-driven discovery" in chemistry! This is a special format, with papers sent in advance (!) and discussed at the meeting. All details here: rsc.li/3QdkKDz - tagging #compchem #ChemSky (and @molecularxtal.bsky.social 🙂)
November 10, 2023 at 5:36 PM
Join us next year for an RSC Faraday Discussions meeting on "data-driven discovery" in chemistry! This is a special format, with papers sent in advance (!) and discussed at the meeting. All details here: rsc.li/3QdkKDz - tagging #compchem #ChemSky (and @molecularxtal.bsky.social 🙂)