SEARCH Articles Figures Tables Application of First Principles Density Functional Theory (DFT) to Polymers Basic Principles of Functional Materials Basic principles of density functional theory Biomimetics functional principles Boltzmann superposition principle material functions Density Functional Theory HSAB principle Density functional theory principles Electronic Structure of Naked, Ligated and Supported Transition Metal Clusters from First Principles Density Functional Calculations First-Principles Implicit Correlation Functionals Form follows function” principle Functional coding principle, proteins Functional redundancy principle Heat function principle Mass function principle Molecular function basic principles Pauli principle function Potential functions selection principles Principle Function and Design of a Vacuum Conveying System Principle of their function Principles of Construction and Function Radial distribution functions from first principle Spectral function basic principles The Basic Principles of Density Functional Theory The Basic Principles of Hormone Function Variational principles orbital functional theory Wave function basic principles Wave function time-dependent variational principle