Assessing the available Density Functional Tight-binding (DFTB) Parameter Set to describe the Electronic Structure of Copper Nanostructures by means of First Principles Density Functional Theory (DFT) calculations

Carbon Dioxide, Copper, Density function theory, Plasmonic materials

Paul Whalley, “Assessing the available Density Functional Tight-binding (DFTB) Parameter Set to describe the Electronic Structure of Copper Nanostructures by means of First Principles Density Functional Theory (DFT) calculations,” URSS SHOWCASE, accessed December 22, 2024, https://urss.warwick.ac.uk/items/show/101.