SEARCH Articles Figures Tables Approximate exchange functionals Are Molecular Exchange-correlation Functionals Transferable to Crystals B3-LYP exchange-correlation functional B3-LYP exchange-correlation functional calculating structural parameters B3-LYP exchange-correlation functional in determination of vibrational spectra B3-LYP exchange-correlation functional reliability of calculated relative energies B3LYP exchange-correlation functional B88 exchange functional B97, exchange-correlation functionals calculating structural parameters B97, exchange-correlation functionals heterocycles Basis functions exchange correlation Becke 88 exchange functional Becke exchange functionals Bond lengths exchange-correlation functionals Classification of Exchange-Correlation Functionals Cooling heat exchange function Correlation function exchange Density Functionals of Exchange Energy Density Functionals of Exchange-Correlation Energy Density exchange-correlation functionals Density functional differential exchange Density functional theory Hartree-Fock exchange Density functional theory Hartree-Fock-Slater exchange Density functional theory exact exchange potential Density functional theory exchange-correlation Density functional theory exchange-correlation energy Density functional theory exchange-correlation functionals Density functional theory exchange-correlation holes Density functionals Perdew-Wang-91 exchange-correlation Dirac exchange energy functional Dirac exchange functional Electronic structure methods exchange-correlation functional Exact exchange energy density functional Exact exchange energy density functional from Fock operator Exact exchange functionals Exact exchange orbital functionals Exchange and Correlation Energy Functionals Exchange correlation functional Exchange correlation functionals, local Exchange correlation functionals, local density approximations Exchange correlation functionals, local theory Exchange correlation functionals, local with experimental data Exchange energy functional Exchange energy functional relativistic Exchange function Exchange function Exchange functional Exchange operator wave function calculations, functionals Exchange resins functional groups Exchange-correlation energy functional Exchange-correlation energy functional gradient-corrected Exchange-correlation energy functional hybrid Exchange-correlation energy functionals Exchange-correlation energy, density functionals Exchange-correlation functional generalized gradient approximation Exchange-correlation functional local density approximation Exchange-correlation functional, for Exchange-correlation functional, in density Exchange-correlation functional/potential Exchange-correlation functionals Exchange-correlation hole functions Exchange-correlation relativistic energy functional Exchange-correlation relativistic functionals Exchange-density functionals Exchange-energy density functional, theory Exchange-energy functionals Exchange—correlation density functional Excitation energy exchange-correlation functional Explicit Relativistic Exchange-Correlation Functionals Fock exchange functional Functional group exchanges Functional group exchanges definition Functionalized Ion Exchange Membrane in Electrodialysis Functionalized polar group exchange Generalized gradient approximations exchange correlation functionals Global hybrid exchange functionals Gradient-corrected exchange-correlation functional Halogen-lithium exchange reactions functionalized compounds Hartree-Fock exchange function Histidine Hydrogen Exchange for Analysis of Protein Folding, Structure, and Function Hohenberg-Kohn theorems exchange correlation functional energy Hybrid exchange functionals Hydroxide exchange membranes functional groups Ion Exchange functional groups Ion exchange function Kohn-Sham theory exchange-correlation energy functional LDA and GGA Exchange Functionals LDA exchange functional Local exchange functional Local exchange functional nonrelativistic Local exchange functional relativistic corrections Local gradient-corrected exchange-correlation functional Local spin-density approximations hybrid exchange functionals Local-scaling density functional theory exchange energy Long-range corrected exchange-correlation functional Mixing exchange functionals Nonlocal exchange functional OPTimized exchange density function Orbital-Dependent Exchange-Correlation Functional Orbital-functional response theory, exchange-only Perdew-Wang exchange functional Perdew-Wang-91 exchange-correlation functional Power exchange function Proton exchange membrane fuel cells functions Relativistic exchange-correlation functional Response time as a function of the thermal driving force for an idealized heat exchanger at different hold-up values Search for Functional Group Exchanges GRX Self exchange-correlation function Semi-empirical Orbital-Dependent Exchange-Correlation Functionals Slater exchange functions Statistical exchange functional The Pair Density. Orbital-dependent Exchange-correlation Functionals The Power Exchange Function The Quest for Approximate Exchange-Correlation Functionals The Structures and Functions of Ion-Exchange Membranes The exchange-correlation functional Time-dependent density functional theory exact exchange Vosko local exchange correlation function Wave functions exchange-correlation holes Xa exchange functional