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Matter Modeling
Bikash Patra's user avatar
Bikash Patra's user avatar
Bikash Patra's user avatar
Bikash Patra
  • Member for 3 years, 7 months
  • Last seen more than a week ago
  • Kolkata, West Bengal, India
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I am a Ph.D student in the field of density functional theory and its application in physics, material science and quantum chemistry calculations.

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Top posts
question
13
Excited state energy gradient during geometry optimization of a target excited state
Feb 20, 2021
question
10
Understanding absorption spectra using TDDFT calculation in NWCHEM
Feb 7, 2021
question
10
Understanding emission spectra using TDDFT calculation
Feb 10, 2021
question
6
Norm conserving LDA fully relativistic pseudopotential in quantum espresso
Apr 28, 2023
question
2
Steps in case of ICHARG=11 in VASP
Jan 25, 2023