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  • Page last updated on Friday, December 17, 2021

Invited talks and Conferences

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Conferences

Recent Presentations

Conferences : 

1.   K. Sumithra, Invited talk: Global Meet On “Computational Modeling and Simulation: Recent Innovations, Challenges & Perspectives”, 2020 Organized by BITS Pilani, India.

2.    K. Sumithra Invited talk:  Computational study of adsorption of some pollutant gases on chemically modified graphene surfaces, National Conference on Frontiers in Medicinal Chemistry and Nanochemistry, Goa University, 14th and 15th February 2020.

3.         A. Sahithi and K. Sumithra, The Adsorption and Sensing of NO, N2O and NO2 On Chemically Modified Graphene Surfaces, DAE Symposium on Current Trends in Theoretical Chemistry (CTTC-2020), Bhabha Atomic Research Centre Mumbai, India, September 23-25, 2021.

4.      A. Sahithi and K. Sumithra, A first-principles study of gas sensing properties of NO, NO2, N2O gases on chemically modified graphene.17th Theoretical Chemistry Symposium (TCS 2021) IISER Kolkata, IACS Kolkata, University of Kalyani and S.N Bose National Centre For Basic Sciences Kolkata, December 11-14, 2021.

5.         A. Sahithi and K. Sumithra Poster:  Band gap engineering in intrinsically doped bilayer graphene. National Conference on Frontiers in Medicinal Chemistry and Nanochemistry, Goa University, 14-15th February 2020.

6.         A. Sahithi and K. Sumithra, Adsorption of gases on Boron and Nitrogen doped graphenes: A Computational study, CCM 2019, Dec 17-18.

7.         A. Sahithi and K. Sumithra NFCFA - national conference on “New frontiers in chemistry –from fundamentals to applications-III” Computational study of adsorption of some gaseous moieties on chemically modified graphene NFCFA 2019/ Dec 20-22.

8.  M. Saisudhakar, T. Vikramaditya, K. Sumithra, Electronic structure calculations of linear and cyclic isothianaphthenes at Nascent Developments in Chemical Sciences: Opportunities for Academia-Industry Collaboration, 2015, BITS Pilani, Pilani Campus.

9.    M. Saisudhakar, T. Vikramaditya, K. Sumithra, Effect of substituents on electronic properties of oligo- and polythiophenes at Eurasia conference on chemical science, Indian Institute of Sciences, Banglore. 2015.

 
   T. Vikramaditya, M. Saisudhakar, K. Sumithra, Diagnostic test to assess the role of Functional, solvent formalism and basis set in determining the optical properties; Eurasia Conference on Chemical Sciences, Indian Institute of Science, Bangalore, India.2015 


   K. Sumithra, Physical and Biophysical Chemistry Theory and Experiment. ​ IIT Bombay, December 4-6, 2015.

12.   Krunal K. Patel and K. Sumithra Computational study of some important van der Waals heterojunctions, CCM, BITS Hyderabad, December 2017.

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