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Material Science DFT Calculations
24 June - 09 July 2024
CTO, MGU Innovation Foundation
Application Engineer, Integrated Microsystem
Application Engineer, Integrated Microsystem
Day 1
7.30 pm IST
DFT and TDDFT calculations, work function calculations
Day 2
7.30 pm IST
Transport calculations with QuantumATK
Day 3
7.30 pm IST
Calculate the band structure of a crystal
Day 4
7.30 pm IST
Phonons, Band structure and Thermoelectric
Day 5
7.30 pm IST
Structure Building
Day 6
7.30 pm IST
Carbon Nanotube Junctions
Day 7
7.30 pm IST
MoS2 Nanotubes
Day 8
7.30 pm IST
Polymer Builder
Day 9
7.30 pm IST
Vibrational modes and Vibration Visualizer
Day 10
7.30 pm IST
How to Setup Basic Molecular Dynamics Simulations
Day 11
7.30 pm IST
Spin-orbit splitting of semiconductor band structures
Day 12
7.30 pm IST
Electrical characteristics of devices using the IV Characteristics study object
Day 13
7.30 pm IST
Building an interface between Ag(100) and Au(111)
With a norminal payment, participants can access MGUIF Paramastra HPC service for one month
Recordings of live sessions will be available for future reference.
Dedicated doubt clearing session is scheduled at the end of the workshop.
eCertificate will be provided
HPC access fee: Rs. 3000 | USD 50 (optional)
Kohinoor, Near Calicut University, Kerala
Dr. Suhaib EP
coordinator@siasrf.com; +917893652869