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guangsheng224

Guangsheng

@guangsheng224

Computational Chemist, DFT and Molecular Modeling

Emiratos Árabes Unidos
Inglés, Chino
Parte de la información aparece en idioma inglés.
Sobre mí
PhD candidate in computational chemistry at a QS top-150 university. I run DFT calculations with CP2K for both molecules and periodic materials: geometry optimization, HOMO/LUMO and orbital analysis, ESP maps, UV-Vis and IR spectra, transition states, and adsorption on surfaces, COFs and MOFs. Every delivery includes publication-ready figures, a clear summary of the results, and a methods paragraph you can use in your manuscript. Send me your structure and goals, and I will confirm the scope and timeline before you order.... Lee más

Habilidades

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guangsheng224
Guangsheng
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Investigación y resúmenes
I will perform dft calculations and molecular modeling for your research