VanDerWaalsD2::AtomParams Struct Reference

C6 and R0 parameters for the VDW interactions. More...

#include <VanDerWaalsD2.h>

Public Member Functions
	AtomParams (double SI_C6=0., double SI_R0=0.)
	Construct given C6 in J-nm^6/mol and R0 in Angstrom.

Public Attributes
double	C6
double	R0

Detailed Description

C6 and R0 parameters for the VDW interactions.

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The documentation for this struct was generated from the following file:

• electronic/VanDerWaalsD2.h