covrad.f90 File Reference

Provides covalent radii for all elements. More...

Data Types
interface	tblite_data_covrad::get_covalent_rad
	Covalent radii for DFT-D3 coordination number. More...

Modules
module	tblite_data_covrad
	Covalent radii (taken from Pyykko and Atsumi, Chem. Eur. J. 15, 2009, 188-197), values for metals decreased by 10 %.

Detailed Description

Provides covalent radii for all elements.