Research Scholar
Dr. Sarika Lohkna
Computational Simulation
Maharashtra, India
5 Years
Joined Mar 2026
Na
0 Consultations
About me
As a PhD in computational chemistry, I have a strong understanding of state-of-the-art quantum chemistry methods like periodic Density Functional Theory (DFT), DFT+U, Density functional Perturbation Theory (DFPT). I have expertise in computational tools such as Quantum ESPRESSO, and post-processing utilities for electronic structure and reaction pathway analysis. I have worked on multiple projects looking into the structure-property relationship of the materials.
Interests: Material modelling, catalysis (thermo-, photo-, and electrocatalysis), sustainable energy and greenhouse gas conversion, materials chemistry and surface science.
Skills
Density Functional TheoryFortranPython (Basic)Computational material ScienceQuantum ChemistryQuantum ESPRESSOOverleafMS OfficeLinuxProblem SolvingProject Management
Certifications
Joint CSIR-UGC NET
