I will do dft calculations and molecular modeling using gaussian 16
WRITER AND EDITOR
About this Gig
Are you looking for expert research assistance in computational chemistry and molecular modeling?
As a professionally certified chemist with extensive experience in quantum mechanical simulations, I provide high-level technical support for projects involving Density Functional Theory (DFT). Whether you are designing new organic molecules, analyzing spectroscopic properties, or electronic properties, I bridge the gap between complex software outputs and publication-ready results.
What I Offer:
- Molecular Modeling and geometry setup using GaussView 6.0 and ChemDraw.
- Managing calculations in Gaussian 16.
- Geometry optimization, frequency calculations, and excited-state analysis using various basis sets (e.g., 6-311g(d)).
- Data Visualization: UV-Vis, IR, and HOMO-LUMO plotting using Microsoft Excel.
- Summarizing raw data into clear, structured, and 100% plagiarism-free technical reports with accurate citations.
Why Choose Me? I am a Graduate Chemist with a deep understanding of kinetics, thermodynamics, and symmetry. Expert-level command of Gaussian 16 and GaussView.
Please contact me before placing an order to discuss research.
Document type:
Reports
•
Other
Industry:
Science
Language:
English
Delivery style preference
Please inform the freelancer of any preferences or concerns regarding the use of AI tools in the completion and/or delivery of your order.
My Portfolio
FAQ
What information do I need to provide to get started?
Please provide the chemical structures (names, SMILES, or 2D sketches) and the specific properties you need calculated (e.g., NLO, UV-Vis, or IR). If you have a specific basis set or functional in mind (like B3LYP/6-311g(d)), please let me know.
Which versions of Gaussian and GaussView do you use?
I primarily use Gaussian 16 and GaussView 6.0
Will you provide the raw output files?
Yes! Depending on your package, I can provide the optimized .log, .chk, and .out files, as well as the formatted Excel data for graphs.
Can you help with interpreting the results for a thesis or journal?
Absolutely. I provide research assistance to help you understand the energy levels, dipole moments, and spectroscopic data so you can describe them accurately in your work.
Is the writing part of your service plagiarism-free?
Yes. I focus on original synthesis and technical paraphrasing. I ensure all scientific concepts are explained in unique prose while maintaining strict academic accuracy.

