Research Projects about DFT

Doping Induced Charge Transfer In Functional Graphene

Doping Induced Charge Transfer in Functional Graphene

Writing Draft

Journal Name: N/A

#doping #2d #charge-transfer #graphene #dft #computational #experimental #ongoing #writing

Jul, 2023 - Present

DFT Study For H₂ Adsorption In A Cage Like Metal Oxide Cluster

DFT study for H₂ adsorption in a cage like metal oxide cluster

Writing Draft

Journal Name: N/A

#adsorption #h2-storage #metal-oxide #dft #computational #ongoing #writing

Aug, 2022 - Present

Tuning The Optoelectronic Properties By End-capped Group Modification For Efficient OSCs

Tuning the optoelectronic properties by end-capped group modification for efficient OSCs

Preprint

Research Square For Preprint

#osc #optoelectronic #solar #dft #computational #completed #preprint #2023

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Finding A More Stable Semiconductor Borophene Using The Theoretical Approach

Finding a More Stable Semiconductor Borophene Using the Theoretical Approach

M.Sc. Thesis (OpenSource)

ResearchGate Opensource

#borophene #semiconductor #msc-project #materials-studio #dft #computational #completed #2021

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