I will help with dft calculations and computational chemistry simulations

Expert in DFT Calculations | Computational Chemistry | Quantum Chemistry Services

Are you looking for DFT calculations, quantum chemistry simulations, or help with computational chemistry tasks, chemistry research, or chemistry articles? You're in the right place!

As a PHD Scholar in Computational Chemistry and an Assistant Researcher with a strong background in chemistry. I have five years of experience in computational chemistry and inorganic chemistry. I have published 25+ articles in well-reputed journals.

DFT study of new materials:-

• Material design, Geometry Optimization, Doping, Molecular dynamic simulations,
• Studying the Structural, Electronic, Optical, Thermal and Mechanical Properties etc.

Services I Offer:

• DFT Calculations (Energy, Geometry Optimization, HOMO-LUMO, etc.)
• TDDFT for UV-Vis Spectra Simulation, ECD
• IR, NMR, and Vibrational Frequency Calculations
• Molecular Orbital and Charge Distribution Analysis
• Data Interpretation and Professional Report Writing
• Assistance with Software: Gaussian, ORCA, and more

Whether you're preparing a research paper, a PhD thesis, or need help.

Don't hesitate to contact me.