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The Lennard-Jones Potential. A commonly used potential-energy function for the interaction of two molecules (see Fig. 18.8) is the Lennard-Jones 6-12 potential:

U(r)=U0[R0r12−2R0r6]

where is the distance between the centers of the molecules andU0andR0are positive constants. The corresponding forceF(r)is given in Eq. (14.26). (a) Graph U(r) and F (r) versus r. (b) Let r1 be the value of r at which U ( r ) = 0, and let r2 be the value of r at which F ( r ). Show the locations ofr1andr2on your graphs of U(r) and F(r). Which of these values represents the equilibrium separation between the molecules? (c) Find the values of r1and r2 in terms of R0, and find the ratior1r2. (d) If the molecules are located a distance r2 apart [as calculated in part (c)], how much work must be done to pull them apart so thatr→∞?

Short Answer

Expert verified

(a) The required graph of U(r) versus r and F ( r ) versus r is shown.

(b) The locations r1 and r2are shown in the graphs.

(c) The values of r1 and r2 in terms of R0 arer1=R0216 and r2=R0 . The ratio is

(d) The work done in this case is equal to the depth of the potential well+U0 .

Step by step solution

01

Identification of the given data.

The given equation of the potential is,

U(r)=U0R0r12−2R0r6 …… (1)

02

(a) Depict the graph of U ( r ) versus r and F ( r )  versus r . 

The force F ( r ) is given as,

F(r)=−dU(r)dr …… (2)

From equation one, solve for the first derivative of the potential energy,

localid="1668311432381" dU(r)dr=U0ddrR0r12−2R0r6=U0−12R012r13−(−12)R06r7=12U0R0−R013r13+R07r7

Substitute this value in equation (2),

F=12U0R0R013r13−R07r7

Therefore, the required graphs are plotted as:-

03

(b) Depict the locations r1 and r2 are shown in the graphs.

The graphs in part (a) exactly shows the location of points r1andr2 . For equilibrium of the system, F = 0 . Thus, the point of equilibrium is r2 because that is where the potential energy U is minimum value.

04

(c) Determine the values of r1 and r2 in terms of R0 and the ratio of r1 and r2.  (d) Determine the work done to pull the molecules apart.

(c)Put equation (i) equal to zero, i.e. U = 0 at pointr=r1.

localid="1668311453049" U0R0r112−2R0r16=0R0r112=2R0r16r1=R0(2)16

At r−r2,F=0

12U0R0R013r213−R07r27=0r2R06=1r2=R0

So, r1and r2in terms of R0is

r2=R0and

r1=R0(2)16

The ratio of r1and r2is,

r1r2=(2)16R0=(2)−16

The work done is equal to the change in potential energy and here the molecule’s potential energy has to be calculated at infinity and then at a distance r=R0 .So, at.

localid="1668227337785" r→∞,U=0W=Δ±«=U(∞)−UR0=−U0R0R012−2R0R06=+U0

Thus, the work done in this case is equal to the depth of the potential well +U0.

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