Density-functional thermochemistry. III. The role of exact exchange

Axel D. Becke

The Journal of Chemical Physics

Electron DensityChemical ThermodynamicsEngineeringPhysicsNatural Sciences +11

COSMO: a new approach to dielectric screening in solvents with explicit expressions for the screening energy and its gradient

Andreas Klamt, Gerrit Schüürmann

Journal of the Chemical Society Perkin Transactions 2

EngineeringComputational ChemistryChemistrySolution (Chemistry)Molecular Design +15

Modelling one‐ and two‐dimensional solid‐state NMR spectra

Dominique Massiot, Franck Fayon, Mickaël Capron, +7

Magnetic Resonance in Chemistry

Nuclear Imaging½ SpinSolid-state Nmr SpectroscopyNuclear PhysicsPhysics +13

The thermodynamic properties of isotopic substances

Harold C. Urey

Journal of the Chemical Society (Resumed)

Inorganic ChemistryChemical EngineeringChemical ThermodynamicsIsotopic SubstancesEngineering +13

Calculation of Equilibrium Constants for Isotopic Exchange Reactions

Jacob Bigeleisen, Maria Goeppert Mayer

The Journal of Chemical Physics

Dynamic EquilibriumQuantum EffectChemical SeparationComputational ChemistryChemistry +14

A Relation Between Internuclear Distances and Bond Force Constants

Richard M. Badger

The Journal of Chemical Physics

Diatomic MoleculesEngineeringMolecular BiologyComputational ChemistryChemistry +15

Lithium Isotope History of Cenozoic Seawater: Changes in Silicate Weathering and Reverse Weathering

Sambuddha Misra, Philip N. Froelich

Science

EngineeringPaleoceanographyPrecambrian GeologyMarine ChemistrySilicate Weathering +14

Lithium isotopic composition and concentration of the upper continental crust

Fang‐Zhen Teng, W. F. McDonough, Roberta L. Rudnick, +4

Geochimica et Cosmochimica Acta

Lithium Isotopic CompositionEngineeringGeologyGeochemical StudyGeochemistry +4

Lithium and its isotopes in major world rivers: implications for weathering and the oceanic budget

Youngsook Huh, Lui‐Heung Chan, Libo Zhang, +1

Geochimica et Cosmochimica Acta

EngineeringBrine MiningWater ResourcesEnvironmental GeochemistryOceanic Budget +6

Lithium isotopic composition of submarine basalts: implications for the lithium cycle in the oceans

Lai Wah Chan, John M. Edmond, G. Thompson, +1

Earth and Planetary Science Letters

Marine GeologyLithium Isotopic CompositionEngineeringLithium CycleMarine Chemistry +6