atomicrad.f90 File Reference

Provides atomic radii for all elements. More...

Data Types
interface	tblite_data_atomicrad::get_atomic_rad
	Get atomic radius for a species. More...

Modules
module	tblite_data_atomicrad
	Atomic radii of the elements.

Variables
real(wp), dimension(max_elem), parameter, public	tblite_data_atomicrad::atomic_rad = aatoau * [ 0.32_wp, 0.37_wp, 1.30_wp, 0.99_wp, 0.84_wp, 0.75_wp, 0.71_wp, 0.64_wp, 0.60_wp, 0.62_wp, 1.60_wp, 1.40_wp, 1.24_wp, 1.14_wp, 1.09_wp, 1.04_wp, 1.00_wp, 1.01_wp, 2.00_wp, 1.74_wp, 1.59_wp, 1.48_wp, 1.44_wp, 1.30_wp, 1.29_wp, 1.24_wp, 1.18_wp, 1.17_wp, 1.22_wp, 1.20_wp, 1.23_wp, 1.20_wp, 1.20_wp, 1.18_wp, 1.17_wp, 1.16_wp, 2.15_wp, 1.90_wp, 1.76_wp, 1.64_wp, 1.56_wp, 1.46_wp, 1.38_wp, 1.36_wp, 1.34_wp, 1.30_wp, 1.36_wp, 1.40_wp, 1.42_wp, 1.40_wp, 1.40_wp, 1.37_wp, 1.36_wp, 1.36_wp, 2.38_wp, 2.06_wp, 1.94_wp, 1.84_wp, 1.90_wp, 1.88_wp, 1.86_wp, 1.85_wp, 1.83_wp, 1.82_wp, 1.81_wp, 1.80_wp, 1.79_wp, 1.77_wp, 1.77_wp, 1.78_wp, 1.74_wp, 1.64_wp, 1.58_wp, 1.50_wp, 1.41_wp, 1.36_wp, 1.32_wp, 1.30_wp, 1.30_wp, 1.32_wp, 1.44_wp, 1.45_wp, 1.50_wp, 1.42_wp, 1.48_wp, 1.46_wp, 2.42_wp, 2.11_wp, 2.01_wp, 1.90_wp, 1.84_wp, 1.83_wp, 1.80_wp, 1.80_wp, 1.73_wp, 1.68_wp, 1.68_wp, 1.68_wp, 1.65_wp, 1.67_wp, 1.73_wp, 1.76_wp, 1.61_wp, 1.57_wp, 1.49_wp, 1.43_wp, 1.41_wp, 1.34_wp, 1.29_wp, 1.28_wp, 1.21_wp, 1.22_wp, 1.36_wp, 1.43_wp, 1.62_wp, 1.75_wp, 1.65_wp, 1.57_wp]
	Atomic radii.

Detailed Description

Provides atomic radii for all elements.