Select list of presentations given by our group
2024
Fluoride Frameworks as Potential Calcium Battery Cathodes
24th International Conference on Solid State Ionics at QEII Centre, London, UK
Talk on 18 Jul 2024 by Dereje Bekele Tekliye
Enhancing material property predictions by leveraging transfer learning techniques
24th International Conference on Solid State Ionics at QEII Centre, London, UK
Talk on 18 Jul 2024 by Reshma Devi Parthasarathy
Exploration of oxyfluoride frameworks as Na-ion cathodes
24th International Conference on Solid State Ionics at QEII Centre, London, UK
Talk on 17 Jul 2024 by Debolina Deb
Utility of transfer learning in computational materials science
Materials in an explosively growing informatics world (CIMTEC) at Hotel Tuscany Inn, Montecatini Terme, Italy
Talk on 21 Jun 2024 by Sai Gautam Gopalakrishnan
Accuracy of meta-generalized gradient approximation functionals in describing correlated transition metal-based systems
International Conference on Sustainable Nanomaterials Integration and Organization for Energy and Environment at Shiv Nadar University, Delhi NCR, India
Talk on 21 Mar 2024 by Sai Gautam Gopalakrishnan
Exploration of NaSICON frameworks as Calcium-ion Battery Cathodes
18th Asian Conference on Solid State Ionics at Meenakshi College for Women, Chennai, India
Poster on 19 Feb 2024 by Dereje Bekele Tekliye
Exploration of polyanionic fluoride-based compounds as Na-ion battery cathodes
18th Asian Conference on Solid State Ionics at Meenakshi College for Women, Chennai, India
Poster on 19 Feb 2024 by Debolina Deb
2023
Applications of machine learning to materials science
Namma Psi-k Workshop at Jawaharlal Nehru Centre for Advanced Scientific Research, Bengaluru, Karnataka, India
Talk on 25 Jul 2023 by Sai Gautam Gopalakrishnan
Critical overview of polyanionic frameworks as positive electrodes for Na-ion batteries
Namma Psi-k conference and workshop at Jawaharlal Nehru Centre for Advanced Scientific Research, Bengaluru, Karnataka, India
Poster on 24 Jul 2023 by Debolina Deb
The effect of the exchange-correlation functionals on migration barrier estimation in battery materials
11th International Conference on Materials for Advanced Technologies at Suntec Singapore Convention and Exhibition Centre, Singapore
Talk on 29 Jun 2023 by Reshma Devi Parthasarathy
Constructing and evaluating machine-learned interatomic potentials for Li-based disordered rocksalts
11th International Conference on Materials for Advanced Technologies at Suntec Singapore Convention and Exhibition Centre, Singapore
Poster on 29 Jun 2023 by Vijay Choyal
Exploration of NaSICON frameworks as calcium-ion battery cathodes
11th International Conference on Materials for Advanced Technologies at Suntec Singapore Convention and Exhibition Centre, Singapore
Talk on 28 Jun 2023 by Dereje Bekele Tekliye
Evaluation of layered oxide frameworks as K-ion cathodes
11th International Conference on Materials for Advanced Technologies at Suntec Singapore Convention and Exhibition Centre, Singapore
Talk on 28 Jun 2023 by Sai Gautam Gopalakrishnan
Materials discovery for energy storage using computations and machine learning
Paired early career fellowship on applied research (PECFAR), Indo-German Science and Technology Centre at Several locations in Germany (HU-Berlin, Universität Paderborn, Universität Bayreuth, HI-Ulm, FZ-Jülich, Universität Münster)
Invited Talks on 25 May 2023 by Sai Gautam Gopalakrishnan
Exploration of NaSICON frameworks as calcium-ion battery cathodes
Functional Oxide Materials and Devices (FOMAD) workshop at Silent Valley Resort, Kalasa, Karnataka, India
Talk on 29 Apr 2023 by Dereje Bekele Tekliye
Developing machine-learned interatomic potentials for Li-based disordered rocksalts
Functional Oxide Materials and Devices (FOMAD) workshop at Silent Valley Resort, Kalasa, Karnataka, India
Poster on 28 Apr 2023 by Vijay Choyal
Critical overview of polyanionic frameworks as positive electrodes for Na-ion batteries
Annual Student Symposium at Department of Materials Engineering, Indian Institute of Science, Bengaluru, India
Talk on 28 Jan 2023 by Debolina Deb
2022
Using computations and machine learning in designing materials for energy storage
Winter school on "Computational modelling and simulations of materials for energy and environment" at Jawaharlal Nehru Centre for Advanced Scientific Research, Bengaluru, India
Invited Talk on 14 Dec 2022 by Sai Gautam Gopalakrishnan
Role of exchange-correlation functionals in migration barrier predictions
6th IEEE-International Conference on Emerging Electronics at Hilton and Hilton Garden Inn, Embassy Manyata Business Park, Bengaluru, India
Invited Talk on 12 Dec 2022 by Sai Gautam Gopalakrishnan
Using the cloud for high performance computing: my perspective
Quarterly Lecture, Society for Shock Wave Research-Institution of Mechanical Engineers at Department of Aerospace Engineering, Indian Institute of Science, Bengaluru, India
Invited Talk on 3 Dec 2022 by Sai Gautam Gopalakrishnan
Role of exchange-correlation functionals on migration barrier predictions in battery materials
International Meeting on Lithium Batteries at International Convention Centre, Sydney, New South Wales, Australia
Poster on 26 Jun 2022 by Sai Gautam Gopalakrishnan
Computational Screening of Positive Electrode Materials for Ca-ion Batteries
Materials Research Society Spring Meeting at Hawai'i Convention Center, Honolulu, HI, USA
Talk on 9 May 2022 by Sai Gautam Gopalakrishnan
Effect of Exchange-Correlation Functionals on the Estimation of Migration Barriers in Battery Materials
American Physical Society March Satellite Meeting at International Centre for Theoretical Sciences, Bengaluru, India
Talk on 15 Mar 2022 by Reshma Devi Parthasarathy
youtube.com/watch?v=qfyF7jWAAtY
2021
Screening chemical spaces for positive electrodes in beyond-Li-ion batteries using computational techniques
Annual General Meeting, Materials Research Society of India
Virtual Invited Talk on 23 Dec 2021 by Sai Gautam Gopalakrishnan
Materials discovery for solar thermochemical water splitting applications using computational techniques
Annual General Meeting, Materials Research Society of India
Virtual Invited Talk on 22 Dec 2021 by Sai Gautam Gopalakrishnan
Theory-guided materials design for energy applications
Materials Advantage Seminar at National Institute of Technology Tiruchirappalli
Virtual Invited Talk on 18 Sep 2021 by Sai Gautam Gopalakrishnan
First principles screening of Ca-Ce-M-O (M = 3d transition metal) oxide perovskites for solar thermochemical applications
Materials Research Society Spring Meeting
Virtual Talk on 19 Apr 2021 by Sai Gautam Gopalakrishnan
2020 and prior
Discovering oxide perovskites with simultaneous cation redox-activity using first-principles for solar thermochemical applications
Pratidhwani Seminar at Indian Institute of Technology Delhi
Virtual Invited Talk on 12 Nov 2020 by Sai Gautam Gopalakrishnan
Estimating off-stoichiometry using density functional theory based calculations and the sub-lattice formalism
American Chemical Society Spring Meeting at Orange County Convention Center, Orlando, FL, USA
Talk on 3 Apr 2019 by Sai Gautam Gopalakrishnan
Role of functional defects in Cu2ZnSnS4 solar cells
Materials Research Society Fall Meeting at Hynes Convention Center, Boston, MA, USA
Invited Talk (on behalf of Prof. Emily A. Carter) on 26 Nov 2018 by Sai Gautam Gopalakrishnan
Need for a SCAN+U framework to describe the oxidation energetics of transition metal oxides
Materials Research Society Fall Meeting at Hynes Convention Center, Boston, MA, USA
Poster on 26 Nov 2018 by Sai Gautam Gopalakrishnan
Effects of Cd and Ag doping in Cu2ZnSnS4 solar cells
International Materials Research Congress at JW Marriott Cancún Resort and Spa, Cancún, Mexico
Talk on 21 Aug 2018 by Sai Gautam Gopalakrishnan
On the balance of intercalation and conversion reactions in battery cathodes
Electrochemical Society Fall Meeting at Gaylord National Resort and Convention Center, National Harbor, MD, USA
Invited Talk (on behalf of Dr. Daniel C. Hannah) on 4 Oct 2017 by Sai Gautam Gopalakrishnan
Thermodynamics and kinetics of Mg intercalation for multivalent cathode applications
PhD Thesis Defense at Chipman Room, Department of Materials Science and Engineering, Massachusetts Institute of Technology
Talk on 25 Apr 2017 by Sai Gautam Gopalakrishnan
Solvent co-intercalation and mobility bottlenecks in Mg-intercalation cathodes
Electrochemical Society Prime Meeting at Hawai'i Convention Center, Honolulu, HI, USA
Talk on 4 Oct 2016 by Sai Gautam Gopalakrishnan
Exploration of the multivalent chemical space for higher energy density batteries
Theory and Applications of Computational Chemistry at University of Washington, Seattle, WA, USA
Invited Talk (delivered for Prof. Pieremanuele Canepa) on 31 Aug 2016 by Sai Gautam Gopalakrishnan
First-principles study of V2O5 polymorphs as Mg (and multi-valent) cathode materials
Gordon Research Conference (Batteries) at Four points Sheraton/Holiday Inn Express, Ventura, CA, USA
Poster on 22 Feb 2016 by Sai Gautam Gopalakrishnan
First-principles study of V2O5 polymorphs as Mg (and multi-valent) cathode materials
Gordon Research Seminar (Batteries) at Four points Sheraton/Holiday Inn Express, Ventura, CA, USA
Talk on 21 Feb 2016 by Sai Gautam Gopalakrishnan
Intercalation phase diagram of Mg in V2O5 from first principles
Materials Research Society Spring Meeting at Moscone Center, San Francisco, CA, USA
Talk on 8 Apr 2015 by Sai Gautam Gopalakrishnan

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