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S L Mounika C.

S L Mounika C.

Master’s Thesis - Computational Materials Modeling (DFT, Python automation for high-throughput analysis)

India flagBangalore, India

Key Skills

Software

Don't disclose

Top Subject Matter

Computational materials modeling
DFT simulations
adsorption studies

Top Data Types

Computer Code ProgrammingComputer Code Programming

Top Task Types

Data CollectionData Collection

Freelancer Overview

Master’s Thesis - Computational Materials Modeling (DFT, Python automation for high-throughput analysis). Brings 2+ years of professional experience across complex professional workflows, research, and quality-focused execution. Core strengths include Don't disclose. Education includes Master of Science, JNTUH University College of Engineering, Science & Technology (2025) and Bachelor of Science, Sarojini Naidu Vanita Maha Vidyalaya (2023). AI-training focus includes data types such as Computer Code and Programming and labeling workflows including Data Collection.

Labeling Experience

Master’s Thesis - Computational Materials Modeling (DFT, Python automation for high-throughput analysis)

Don't discloseData CollectionData Collection

Conducted computational and analytical work that supported experimental validation by extracting and interpreting adsorption-related results for materials research. Built and applied Python-based workflows to automate high-throughput extraction and analysis of simulation outputs in Linux/HPC settings. Focused on selecting and screening energetically favorable structures by processing computed metrics across multiple configurations. • Automated data extraction pipelines for high-throughput analysis. • Performed screening of adsorption configurations to identify favorable structures. • Ran first-principles DFT simulations and compared adsorption energies/structural stability. • Validated computational outputs against experimental data to improve predictive reliability.

2024 - 2025

Education

J

JNTUH University College of Engineering, Science & Technology

Master of Science, Analytical Chemistry

Master of Science
2023 - 2025
I

IISER Kolkata

Unspecified Degree (Summer Research Fellowship), Computational Materials Modeling

Unspecified Degree (Summer Research Fellowship)
2024 - 2024

Work History

A

Amrita Vishwa Vidyapeetham

Master's Thesis Student (Computational Materials Modeling)

Bangalore
2025 - 2025
I

IISER Kolkata

Summer Research Fellow (Materials Research)

Kolkata
2024 - 2024