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Bayesian approach to electron correlation in density functional theory
Bayesian electron correlation density functional theory Chemical Physics
2012/5/17
In the present communication the Bayesian conditional probability approach is applied to the wave function of a many-electron system that results in appearance of a quantum vector potential in the DFT...
Beyond the Random Phase Approximation for the Electron Correlation Energy: The Importance of Single Excitations
the Electron Correlation Energy Single Excitations
2010/11/17
The random phase approximation (RPA) for the electron correlation energy, combined with the exact-exchange energy, represents the state-of-the-art exchange-correlation functional within density-funct...
Beyond the Random Phase Approximation for the Electron Correlation Energy: The Importance of Single Excitations
Beyond the Random Phase Approximation Electron Correlation Importance of Single Excitations
2010/11/22
The random phase approximation (RPA) for the electron correlation energy, combined with
the exact-exchange energy, represents the state-of-the-art exchange-correlation functional within density-funct...
Two-Center Electron-Electron Correlation within the Independent Event Model
Two-Center Electron-Electron the Independent Event Model
2010/10/28
The Independent Event Model (IEVM) is used to analyze collision processes for systems with three and four electrons, in situations where up to three active electrons are involved and dynamical correla...