Ab initio investigation of the adsorption of zoledronic acid molecule on hydroxyapatite (001) surface: an atomistic insight of bone protection - Ri, Mun-Hyok; Yu, Chol-Jun; Jang, Yong-Man; Kim, Song-Un (Journal of materials science, 2016)
Keywords: Acids; Adsorption; Analysis; binding capacity; Biomedical materials; Bonding; Bones; Characterization and Evaluation of Materials; Chemical properties; Chemistry and Materials Science; Classical Mechanics; Crystallography and Scattering Methods; Density functional theory; Density functionals; Free energy; Heat of formation; Hydroxyapatite; Investigations; Materials Science; Original Paper; Polymer Sciences; Solid Mechanics; Surface chemistry; Surgical implants; High Occupied Molecular Orbital; Phosphonate Group; Lower Unoccupied Molecular Orbital; Zoledronic Acid; Adsorption Energy