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Recall the energy levels of this system, and its ground state wave function φ0r.. We wish to obtain an upper bound on this ground state energy by the variational method.. a Using perturb

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Properties of a Bose–Einstein Condensate

By cooling down a collection of integer spin atoms to a temperature of less than one micro-Kelvin, one can observe the phenomenon of Bose–Einstein condensation This results in a situation where a large fraction of the atoms are in the same quantum state Consequently, the system possesses remarkable

coherence properties We study here the ground state of such an N particle

system, hereafter called a condensate We will show that the nature of the system depends crucially on whether the two-body interactions between the atoms are attractive or repulsive

19.1 Particle in a Harmonic Trap

We consider a particle of mass m placed in a harmonic potential with a fre-quency ω/2π The Hamiltonian of the system is

ˆ

H = pˆ2

2m+

1

2

r2 ,

where ˆr = (ˆ x, ˆ y, ˆ z) and ˆ p = (ˆ p x , ˆ p y , ˆ p z) are respectively the position and

momentum operators of the particle We set a0=

¯

h/(mω).

19.1.1 Recall the energy levels of this system, and its ground state wave

function φ0(r).

19.1.2 We wish to obtain an upper bound on this ground state energy by

the variational method We use a Gaussian trial wave function:

ψ σ (r) = 1

2π) 3/4 exp(−r2/(2σ2)) with σ > 0 (19.1)

The values of a relevant set of useful integrals are given below.

By varying σ, find an upper bound on the ground state energy Compare

the bound with the exact value, and comment on the result

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194 19 Properties of a Bose–Einstein Condensate

Formulas:



|ψ σ (r)|2dx dy dz = 1



|ψ σ (r)|4dx dy dz = 1

(2π) 3/2

1

σ3



x2|ψ σ (r)|2dx dy dz = σ

2

2

 

∂ψ σ (r)

∂x



2dx dy dz = 1

2

19.2 Interactions Between Two Confined Particles

We now consider two particles of equal masses m, both placed in the same

harmonic potential We denote the position and momentum operators of the two particles by ˆr1, ˆr2 and ˆp1, ˆp2

19.2.1 In the absence of interactions between the particles, the Hamiltonian

of the system is

ˆ

H = ˆp21

2m+

ˆ

p22

2m+

1

2

r21+1

2

r22 .

(a) What are the energy levels of this Hamiltonian?

(b) What is the ground state wave function Φ0(r1, r2)?

19.2.2 We now suppose that the two particles interact via a potential v( r1

r2) We assume that, on the scale of a0, this potential is of very short range

and that it is peaked around the origin Therefore, for two functions f (r) and g(r) which vary appreciably only over domains larger than a0, one has



f (r1) g(r2) v(r1− r2) d3r1d3r2 4π¯ h

2a m



f (r) g(r) d3r (19.2)

The quantity a, which is called the scattering length, is a characteristic of the

atomic species under consideration It can be positive (repulsive interaction)

or negative (attractive interaction) One can measure for instance that for sodium atoms (isotope 23Na) a = 3.4 nm, whereas a = −1.5 nm for lithium

atoms (isotope7Li)

(a) Using perturbation theory, calculate to first order in a the shift of the

ground state energy of ˆH caused by the interaction between the two

atoms Comment on the sign of this energy shift

(b) Under what condition on a and a0is this perturbative approach expected

to hold?

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19.3 Energy of a Bose–Einstein Condensate

We now consider N particles confined in the same harmonic trap of angular frequency ω The particles have pairwise interactions through the potential

v(r) defined by (19.2) The Hamiltonian of the system is

ˆ

H =

N



i=1

 ˆ

p2i 2m+

1

2

2rˆ2i

 + 1 2

N



i=1

N



j=1

j=i v(ˆ r i − ˆr j )

In order to find an (upper) estimate of the ground state energy of the system,

we use the variational method with factorized trial wave functions of the type:

Ψ σ (r1, r2, , r N ) = ψ σ (r1) ψ σ (r2) ψ σ (r N ) ,

where ψ σ (r) is defined in (19.1).

19.3.1 Calculate the expectation values of the kinetic energy, of the potential

energy and of the interaction energy, if the N particle system is in the state

|Ψ σ :

Ek(σ) = Ψ σ |

N



i=1

ˆ

p i2 2m |Ψ σ  Ep(σ) = Ψ σ |

N



i=1

1

2

2rˆi2|Ψ σ 

Eint(σ) = Ψ σ |1

2

N



i=1

N



j=1

j=i v(ˆ r i − ˆr j)|Ψ σ 

We set E(σ) = Ψ σ | ˆ H |Ψ σ .

19.3.2 We introduce the dimensionless quantities ˜E(σ) = E(σ)/(N ¯ hω) and

˜

σ = σ/a0 Give the expression of ˜E in terms of ˜ σ Cast the result in the form

˜

E(σ) = 3

4

1

˜

σ2 + ˜σ2

+ η

˜

σ3

and express the quantity η as a function of N , a and a0 In all what follows,

we shall assume that N  1.

19.3.3 For a = 0, recall the ground state energy of ˆ H.

19.4 Condensates with Repulsive Interactions

In this part, we assume that the two-body interaction between the atoms is

repulsive, i.e a > 0.

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196 19 Properties of a Bose–Einstein Condensate

19.4.1 Draw qualitatively the value of ˜E as a function of ˜ σ Discuss the variation with η of the position of its minimum ˜ Emin

19.4.2 We consider the case η  1 Show that the contribution of the kinetic

energy to ˜E is negligible In that approximation, calculate an approximate

value of ˜Emin

19.4.3 In this variational calculation, how does the energy of the

conden-sate vary with the number of atoms N ? Compare the prediction with the

experimental result shown in Fig 19.1

19.4.4 Figure 19.1 has been obtained with a sodium condensate (mass m =

3.8 × 10 −26 kg) in a harmonic trap of frequency ω/(2π) = 142 Hz.

(a) Calculate a0 and ¯hω for this potential.

(b) Above which value of N does the approximation η  1 hold?

(c) Within the previous model, calculate the value of the sodium atom scat-tering length that can be inferred from the data of Fig 19.1 Compare the

result with the value obtained in scattering experiments a = 3.4 nm Is it

possible a priori to improve the accuracy of the variational method?

Fig 19.1 Energy per atom E/N in a sodium condensate, as a function of the

number of atoms N in the condensate

19.5 Condensates with Attractive Interactions

We now suppose that the scattering length a is negative.

19.5.1 Draw qualitatively ˜E as a function of ˜ σ.

19.5.2 Comment on the approximation (19.2) in the region σ → 0.

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19.5.3 Show that there exists a critical value ηc of |η| above which ˜ E no

longer has a local minimum for a value ˜σ = 0 Calculate the corresponding size σc as a function of a0

19.5.4 In an experiment performed with lithium atoms (m = 1.17 ×

10−26 kg), it has been noticed that the number of atoms in the condensate never exceeds 1200 for a trap of frequency ω/(2π) = 145 Hz How can this

result be explained?

19.6 Solutions

Section 19.1: Particle in a Harmonic Trap

19.1.1 The Hamiltonian of a three-dimensional harmonic oscillator can be

written

ˆ

H = ˆ H x+ ˆH y+ ˆH z ,

where ˆH i represents a one dimensional harmonic oscillator of same frequency

along the axis i = x, y, z We therefore use a basis of eigenfunctions of ˆ H of the form φ(x, y, z) = χ n x (x) χ n y (y) χ n z (z), i.e products of eigenfunctions of

ˆ

H x , ˆ H y , ˆ H z , where χ n (x) is the nth Hermite function The eigenvalues of ˆ H can be written as E n = (n + 3/2)¯ hω, where n = n x + n y + n zis a non-negative integer

The ground state wave function, of energy (3/2)¯ hω, corresponds to n x = n y=

n z = 0, i.e

φ0(r) = 1

(a2π) 3/4exp[−r2/(2a2)]

19.1.2 The trial wave functions ψ σ are normalized In order to obtain an upper bound for the ground-state energy of ˆH, we must calculate E(σ) =

ψ σ | ˆ H |ψ σ  and minimize the result with respect to σ Using the formulas

given in the text, one obtains



ψ σ | 2m pˆ2 |ψ σ



= 3 ¯h

2

2m

1

2



ψ σ |122r2|ψ σ



= 3

2

2

σ2

2 and

E(σ) = 3

a2

σ2 +σ

2

a2

This quantity is minimum for σ = a0, and we find Emin(σ) = (3/2) ¯ hω In

this particular case, the upper bound coincides with the exact result This is due to the fact that the set of trial wave functions contains the ground state wave function of ˆH.

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198 19 Properties of a Bose–Einstein Condensate

Section 19.2: Interactions between Two Confined Particles

19.2.1 (a) The Hamiltonian ˆH can be written as ˆ H = ˆ H1+ ˆH2, where ˆH1

and ˆH2 are respectively the Hamiltonians of particle 1 and particle 2 A basis

of eigenfunctions of ˆH is formed by considering products of eigenfunctions

of ˆH1 (functions of the variable r1) and eigenfunctions of ˆH2 (functions of

the variable r2) The energy eigenvalues are E n = (n + 3)¯ hω, where n is a

non-negative integer

(b) The ground state of ˆH is:

Φ0(r1, r2) = φ0(r1) φ0(r2) = 1

a3π 3/2 exp"

−(r2

1+ r22)/(2a20)#

.

19.2.2 (a) Since the ground state of ˆH is non-degenerate, its shift to first order in a can be written as

∆E = Φ0|˜v|Φ0 =



0(r1, r2)|2

v(r1− r2) d3r1d3r2

 4π¯ h

2a m



0(r)|4d3r = 4π¯ h

2a m

1

(2π) 3/2

1

a3

therefore

∆E

¯

=

2

π

a

a0 . For a repulsive interaction (a > 0), there is an increase in the energy of the system Conversely, in the case of an attractive interaction (a < 0), the ground

state energy is lowered

(b) The perturbative approach yields a good approximation provided the

energy shift ∆E is small compared to the level spacing ¯ hω of ˆ H Therefore,

one must have|a|  a0, i.e the scattering length must be small compared to the spreading of the ground state wave function

Section 19.3: Energy of a Bose–Einstein Condensate

19.3.1 Using the formulas provided in the text, one obtains:

Ek(σ) = N 3

4

¯

h2

2 Ep(σ) = N 3

4

2σ2

Eint(σ) = N (N − 1)

2

2

π ¯

aa2

σ3 Indeed, there are N kinetic energy and potential energy terms, and N (N −1)/2

pairs which contribute to the interaction energy

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19.3.2 With the change of variables introduced in the text, one finds

˜

E(σ) = 3

4

1

˜

σ2 + ˜σ2

+N √ − 1 2π

a

a0

1

˜

σ3

so that

η = N √ − 1 2π

a

a0 .

19.3.3 If the scattering length is zero, there is no interaction between the

particles The ground state of the system is the product of the N functions

φ0(r i ) and the ground state energy is E = (3/2)N ¯ hω.

Section 19.4: Condensates with Repulsive Interactions

19.4.1 Figure 19.2 gives the variation of ˜E(˜ σ) as a function of ˜ σ for increas-ing values of η The value of the function for a given value of ˜ σ increases as η

increases For large ˜σ, the behavior of ˜ E does not depend on η It is dominated

by the potential energy term 3˜σ2/4.

The minimum ˜Emin increases as η increases This minimum corresponds

the point where the potential energy term, which tends to favor small values

of σ, matches the kinetic and interaction energy terms which, on the contrary, favor large sizes σ Since the interactions are repulsive, the size of the system

is larger than in the absence of interactions, and the corresponding energy is also increased

Fig 19.2 Variation of ˜E(˜ σ) with ˜ σ for η = 0, 10, 100, 1000 (from bottom to top)

19.4.2 Let us assume η is much larger than 1 and let us neglect a priori

the kinetic energy term 1/˜ σ2 The function (3/4)˜ σ2+ η/˜ σ3 is minimum for

˜

σmin= (2η) 1/5where its value is

˜

Emin=5

4(2η)

2/5

One can check a posteriori that it is legitimate to neglect the kinetic energy

term 1/˜ σ2 In fact it is always smaller than one of the two other contributions

to ˜E:

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200 19 Properties of a Bose–Einstein Condensate

• For ˜σ < ˜σmin, one has 1/˜ σ2 η/˜σ3

• For ˜σ > ˜σmin, one has 1/˜ σ2 ˜σ2

19.4.3 For a number of atoms N  1, the energy of the system as calculated

by the variational method is

E

N =

5

 2

π N

a

a0

2/5

This variation of E/N as N 2/5is very well reproduced by the data In Fig 19.3

we have plotted a fit of the data with this law One finds E/N  αN 2/5with

α = 8.2 × 10 −33 Joule.

Fig 19.3 Fit of the experimental data with an N 2/5law

19.4.4 (a) One finds a0= 1.76µm and ¯hω = 9.4 10 −32 Joule.

(b) Consider the value a = 3.4 nm given in the text The approximation

η  1 will hold if N  1300 This is clearly the case for the data of Fig 19.1.

(c) The coefficient α = 8.2 × 10 −33 Joule found by fitting the data leads to

a = 2.8 nm This value is somewhat lower than the expected value a = 3.4 nm This is due to the fact that the result (19.3), E/(N ¯ hω)  1.142 (Na/a0)2/5, obtained in a variational calculation using simple Gaussian trial functions, does not yield a sufficiently accurate value of the ground state energy With more appropriate trial wave functions, one can obtain, in the mean field

ap-proximation and in the limit η  1: Egs/(N ¯ hω)  1.055 (Na/a0)2/5 The fit

to the data is then in agreement with the experimental value of the scattering length

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Section 19.5: Condensates with Attractive Interactions

19.5.1 The function ˜E(˜ σ) is represented in Fig 19.4 We notice that it has

a local minimum only for small enough values of η For η < 0, there is always

a minimum at 0, where the function tends to−∞.

-10 -5 0 5

10 ( )

σ

Fig 19.4 Plot of ˜E(˜ σ) for η = 0; η = −0.1; η = −0.27; η = −1 (from top to bottom)

19.5.2 The absolute minimum at σ = 0 corresponds to a highly compressed

atomic cloud For such small sizes, approximation (19.2) for a “short range” potential loses its meaning Physically, one must take into account the forma-tion of molecules and/or atomic aggregates which have not been considered here

19.5.3 The local minimum at ˜σ = 0 disappears when ˜ E(˜ σ) has an inflexion point where the derivative vanishes This happens for a critical value of η

determined by the two conditions:

d ˜E

σ = 0

d2E˜ d˜σ2 = 0

This leads to the system

0 = 1

˜

σ4 + 1− 2η

˜

σ5

0 = 3

˜

σ4 + 1 +

˜

σ5

from which we obtain

c| = 2

55/4  0.27 σ˜c= 1

51/4  0.67

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202 19 Properties of a Bose–Einstein Condensate

or σc 0.67 a0 If the local minimum exists, i.e for|η| < |ηc|, one can hope

to obtain a metastable condensate, whose size will be of the order of the minimum found in this variational approach On the other hand, if one starts with a value of |η| which is too large, for instance by trying to gather too

many atoms, the condensate will collapse, and molecules will form

19.5.4 For the given experimental data one finds a0= 3.1µm, and a critical number of atoms:

Nc=√ 2π ηc a0

|a| ∼ 1400 ,

in good agreement with experimental observations

19.7 Comments

The first Bose–Einstein condensate of a dilute atomic gas was observed in Boulder (USA) in 1995 (M.H Anderson, J.R Ensher, M.R Matthews, C.E

Wieman, and E.A Cornell, Science 269, 198 (1995)) with rubidium atoms.

The experimental data shown in this chapter for a sodium condensate come from the results published by M.-O Mewes, M.R Andrews, N.J van

Druten, D.M Kurn, D.S Durfee, and W Ketterle, Phys Rev Lett 77, 416

(1996) The measurement of the energy E/N is done by suddenly switching

off the confining potential and by measuring the resulting ballistic expansion The motion of the atoms in this expansion essentially originates from the conversion of the potential energy of the atoms in the trap into kinetic energy The experimental results on lithium have been reported by C Bradley,

C.A Sackett, and R.G Hulet, Phys Rev Lett 78, 985 (1997).

The Nobel prize 2001 has been awarded to E Cornell, W Ketterle, and

C Wieman for the achievement of Bose-Einstein condensation in dilute gases

of alkali atoms, and for early fundamental studies of the properties of the condensates

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