GMTKN-55
Emerging4papers using it
2023first seen
The GMTKN-55 dataset is a comprehensive benchmark that contains a diverse set of molecular and crystal systems used to evaluate the performance of density-functional theory (DFT) methods and dispersion corrections in computational chemistry.
Papers using GMTKN-55 (4)
- Gold-Standard Chemical Database 137 (GSCDB137): A diverse set of accurate energy differences for assessing and developing density functionalsAccurate and scalable exchange-correlation with deep learningConsistent GMTKN55 and molecular-crystal accuracy using minimally empirical DFT with XDM(Z) dispersionCan G4-like Composite Ab Initio Methods Accurately Predict Vibrational
Harmonic Frequencies?