Table 1 Translatioanl diffusion tensor for the cases with R = 0.7 nm.

From: Diffusion Tensors of Arbitrary-Shaped Nanoparticles in Fluid by Molecular Dynamics Simulation

θ(°)

Dt_MSD(×10−9m2/s)

Dt_VAF (×10−9m2/s)

Relative Difference(%)

60

10.50

9.10

13.3

90

7.00

8.12

16.0

120

5.48

5.56

1.38

180

4.85

4.90

1.13