Final update on the "AI/ML workshop for Materials Science" that we organised with @keeeto2000. All workshop lectures, tutorials, and videos are available now, free for all. Check for slides and videos. @iiscbangalore @iiscmte @ucl @UKRI_News @royalsociety

Our collaborative work with @Maji_TK's group is out on @ChemSusChem. Here, @SougatPurohit looked at stable Na coordination sites, intercalation mechanism, and voltage curves in COFs using computations. Take a look! @iiscbangalore @iiscmte @jncasr

Tagging @iiscbangalore and @iiscmte, where the work was done.

Spoke about advances and use cases for machine learning in materials design and discovery at the @IITACB on Saturday. Following link contains the full talk. Hope the contents are useful and interesting for all. Do take a look! @iiscbangalore @iiscmte

Listing Sai-mat group contributors. Hands-on sessions: @SougatPurohit, @DerejeBT, Debsundar Dey, @TejusRohatgi, Reshma Devi, and Pritam Ghosh. Logistics: @Debolina_Deb_ , Ankur Srivastava, Javeed Ahmad Dar. Volunteering: Satvik Kashyap, Avaneesh, Subramanian, Anuraj, & Achinthya.

Looking forward to the 2-day workshop on "AI/ML for Materials Science" that my group is organising with @keeeto2000. Hope to be able to teach several ML techniques that are useful for materials and some lovely discussion. @iiscmte @iiscbangalore @ucl @royalsociety @UKRI_News

Also picked up by @IndiaToday

Finishing 2024 with our work on optimal ways to use transfer learning & creating generalizable models for materials getting out on @Nature_NPJ #CompMater. Reshma's work, in collab with @keeeto2000. A nice holiday read! @iiscbangalore @iiscmte @UCLChemistry

After a long period of review hibernation, happy to note that our work on exploring oxyfluoride chemistries as possible Na-ion battery cathodes is finally out on @ChemMater. Led by @Debolina_Deb_. @iiscbangalore @iiscmte

Bit of a late notice: will be giving a talk at @UNSW (Room G07- SEB/E8) today at 3pm local time on some of the latest research done by our group. Hosted by @DipanKundu10 Do join in if you are around! @iiscbangalore @iiscmte

@keeeto2000 and I will be running a 'AI/ML for materials science' workshop @iiscmte @iiscbangalore on Jan 7-8, 2025. Funded by @royalsociety and @UKRI_News. Registration is free but seats are highly limited. Register soon at

@WileyGlobal's Advanced Theory & Simulations is launching a special issue on "Applications of AI & computations for materials/molecular design for decarbonisation" commemorating @Shell_India.ai '24 conference. Guest editing the issue. Submissions welcome! @iiscbangalore @iiscmte

RT @iiscmte: Celebrating a proud achievement for IISc Materials Engineering! Prof. Sai Gautam Gopalakrishnan has been honored with the pres…

Paper at

And that's a wrap of the NMSB-1 conference. Nice collection of talks and discussions. Good show @iitbombay And capping it off with Santosh from the group getting the best poster. @iiscmte @iiscbangalore

Looking forward to the first National Meeting on Sodium (ion) Batteries at @iitbombay. Talk on Oct 5 (Saturday), 5pm. @Debolina_Deb_& Santosh present posters at the conference. Looking forward to stimulating talks & discussions! @iiscbangalore @iiscmte