Interaction

Attractive

Value (Å⁶ kcal/mol)

Repulsive

Value (Ź² × 10³ kcal/mol)

ACh

$A_{\text{ACh}}$

23.38

$B_{\text{ACh}}$

54.386

RAV

$A_{\text{RAV}}$

23.43

$B_{\text{RAV}}$

56.598

CNT

$A_{\text{CNT}}$

17.40

$B_{\text{CNT}}$

29.000

Spherical shell ( $r_{s_1}=2.52$ )

$A_{s_1}$

23.52

$B_{s_1}$

54.825

Spherical shell ( $r_{s_2}=2.03$ )

$A_{s_2}$

23.24

$B_{s_2}$

53.946

An ellipsoid configuration (RAV)

$A_l$

23.43

$B_l$

56.598

Cylindrical configuration (RAV)

$A_c$

23.43

$B_c$

56.598