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Ligand-Modified Boron-Doped Diamond Surface: DFT Insights into the Electronic Properties of Biofunctionalization

With the increasing power of computation systems, theoretical calculations provide a means for quick determination of material properties, laying out a research plan, and lowering material development costs. One of the most common is Density Functional Theory (DFT), which allows us to simulate the s...

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Detalles Bibliográficos
Publicado en:Materials (Basel)
Main Authors: Dec, Bartłomiej, Sobaszek, Michał, Jaramillo-Botero, Andrés, Goddard, William Andrew, Bogdanowicz, Robert
Formato: Artigo
Idioma:Inglês
Publicado: MDPI 2019
Assuntos:
Acceso en liña:https://ncbi.nlm.nih.gov/pmc/articles/PMC6766244/
https://ncbi.nlm.nih.gov/pubmed/31505785
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/ma12182910
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