Exploring the biointerfaces: <i>ab initio</i> investigation of nano-montmorillonite clay, and its interaction with unnatural amino acids

Fernando, Ashan; Khan, Desmond; Hoffmann, Mark R.; Çakır, Deniz

doi:10.1039/d3cp02944a

Phys. Chem. Chem. Phys.

2023

DOI: 10.1039/d3cp02944a

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Exploring the biointerfaces: ab initio investigation of nano-montmorillonite clay, and its interaction with unnatural amino acids

Ashan Fernando,

Desmond Khan,

Mark R. Hoffmann

et al.

Abstract: We investigated the interaction between biomimetic Fe and Mg co-doped montmorillonite nano clay and eleven unnatural amino acids. Employing three different functionals (PBE-GGA, PBE-GGA+U, and HSE06), we examined the clay's...

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Exploring the biointerfaces: ab initio investigation of nano-montmorillonite clay, and its interaction with unnatural amino acids

Abstract: We investigated the interaction between biomimetic Fe and Mg co-doped montmorillonite nano clay and eleven unnatural amino acids. Employing three different functionals (PBE-GGA, PBE-GGA+U, and HSE06), we examined the clay's...

Cited by 0 publications

References 70 publications

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