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Energy decomposition analysis of the intermolecular interaction energy between different gas molecules (H 2, O 2, H 2 O, N 2, CO 2, H 2 S, and CO) and selected Li+-doped graphitic molecules: DF-SAPT (DFT) calculations
Energy decomposition analysis of the intermolecular interaction energy between different gas molecules (H 2, O 2, H 2 O, N 2, CO 2, H 2 S, and CO) and selected Li+-doped graphitic molecules: DF-SAPT (DFT) calculations
Determination of proton conductivity of phosphoric acid doped PBI-La2Ti2O7nanocompositemembranes by a model for application in high temperature proton exchange membrane fuel cell (HT-PEMFC)
Investigating the influence of vacancy and rhodium doping on nickel-based single-atom catalysts for methane dehydrogenation: A Br?nsted-Evans-Polanyi analysis via density functional theory
Investigating the influence of vacancy and rhodium doping on nickel-based single-atom catalysts for methane dehydrogenation: A Br?nsted-Evans-Polanyi analysis via density functional theory
Publications
immobilized Pd nanoparticles on (acac)-modified silica: synthesis, characterization and catalytic activity for coupling
study of bronsted acidic ionic liquids and use of them in the synthesis of some organic compounds
Synthesis of antibacterial flower-like silver nanostructures by self-assembly of diphenylalanine peptide on graphite
Synthesis of antibacterial flower-like silver nanostructures by self-assembly of diphenylalanine peptide on graphite
Synthesis of a-cyano hydroxylamines via three-component reactions and its computational mechanistic study
Structurally Tunable pH-responsive Phosphine Oxide Based Gels by Facile Synthesis Strategy
Surface modified layered double hydroxide/polyaniline nanocomposites Synthesis, characterization and Pb2 removal
In situ synthesis of fluorapatite-ZnO nanocomposite powder via mechanical alloying for biomedical applications
In situ synthesis of fluorapatite-ZnO nanocomposite powder via mechanical alloying for biomedical applications