A practicable real-space measure and visualization of static electron-correlation effects.
By Stefan Grimme, Andreas Hansen. 2015
232 citations recorded by the source corpus.
Subfields: Atomic and Molecular Physics, and Optics, Physical and Theoretical Chemistry
How researchers see this paper
The researchers whose trusted networks rank it highest, strongest advocate first. Every researcher gets a different order.
In Atomic and Molecular Physics, and Optics
In Physical and Theoretical Chemistry
Citations in the corpus
- Fast and Uncertainty-Aware Directional Message Passing for Non-Equilibrium Molecules (2020, methodology): “Furthermore, Fermi-smearing with an electronic temperature of 5000 K was applied, which is helpful both for SCF convergence and the approximate description of static correlation effects [4].”