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Workshop and Symposium on
Advanced Simulation Methods: DFT, MD and BeyondBasic Principles and Modern Insights
Confirmed Invited Speakers• Aftab Alam, IIT Bombay• Amalendu Chandra, IIT Kanpur• Amrita Bhattacharya, IIT Bombay• Arnab Mukherjee, IISER Pune• Arun Venkatnathan, IISER Pune• Ashok Arya, BARC• Ayan Dutta, IACS• Biman Jana, IACS• B. Jayaram, IIT Delhi• C. N. Ramachandran, IIT Roorkee • Chiranjib Majumder, BARC• G. P. Das, IIT Kharagpur• Gopalan Rajaraman, IIT Bombay• Govardhan Reddy, IISc• Indra Dasgupta, IACS• Jagannath Mondal, TIFR Hyderabad• Mithun Radhakrishna, IIT Gandhinagar• Mukul Kabir, IISER Pune• Nishant Nair, IIT Kanpur• Parbati Biswas, DU• Pradipta Bandopadhyay, JNU• Prasenjit Ghosh, IISER Pune• Pratim Chattaraj, IIT Kharagpur• Priya Mahadevan, SNBNCBS• Ranjit Biswas, SNBNCBS• S. Balasubramanian, JNCASR• Sanjoy Bandyopadhyay, IIT Kharagpur• Satyavani Vemparala, IMSc• Snehasis Daschakraborty, IIT Patna• Sourav Pal, IISER Kolkata• Srabani Taraphder, IIT Kharagpur• Swapan Pati, JNCASR• Tamisra Pal, TU Darmstadt• Tanmay Das, IISc• V. Kanchana, IIT Hyderabad
OrganizersDr. Saswata Bhattacharya, ConvenorEmail: [email protected]
Dr. Hemant K. Kashyap, ConvenorEmail: [email protected]
Dr. M. Ali Haider, Workshop coordinatorEmail: [email protected]
Dr. Manish Agarwal, SecretaryEmail: [email protected]
Dr. N. M. Anoop Krishnan, TreasurerEmail: [email protected]
ASM2019 is a first-of-its-kind conference dedicated to advanced computational methods such as Density Functional Theory (DFT), Molecular Dynamics (MD) simulation techniques and their applications to solve various multi-scale and multidisciplinary research problems. This five-day hands-on tutorial workshop cum symposium introduces the basic and current developments in DFT, MD and beyond methodologies for an intended audience of researchers entering the field, predominantly PhD. students and postdocs.
The hands on workshop on Density Functional Theory (DFT) will cover the basic principles and advance simulations techniques to determine various physicochemical properties in materials science. The hands on workshop on Molecular Dynamics (MD) simulations will introduce basics of length and time scales challenges, all-atom, ab initio and coarse-grained simulations; various force-fields, etc. It will aim to compute static and dynamic properties of simple and complex liquids from the simulation trajectories; Free energy estimations; collective variables with examples.
Registration is open! Last Date: 5th February 2019
website: http://asm2019.iitd.ac.in Email: [email protected]
Jointly organized by Dept. of Physics, Chemistry, Chem. Eng., Civil Eng., CSC and HPC group at IIT Delhi
March 6 - 10 2019 (Under TEQIP-III and CEP)Venue: Indian Institute of Technology Delhi, New Delhi, India