Gas phase model of an ionic liquid: semi-empirical and ab initio bonding and molecular structure

Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density

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Electron Density, Gradient Expansions, Engineering +14

The calculation of small molecular interactions by the differences of separate total energies. Some procedures with reduced errors

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Engineering, Proton-coupled Electron Transfer, Computational Chemistry +16

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Altmetrics, Physics, Donut Icon +10

Note on an Approximation Treatment for Many-Electron Systems

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Numerical Analysis, Engineering, Zero-order Approximation +16

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Solid-state Ionic, Inorganic Chemistry, Chemical Engineering +11