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Departament de Fìsica i Enginyeria Nuclear, Campus Nord B4-B5, Universitat Politècnica de Catalunya,
Barcelona, Spain
G.E. Astrakharchik, J. Boronat, O.N.Osychenko, Yu.E. Lozovik, Y. Lutsyshyn
Grenoble, 7th of July, 2010
MONTE CARLO STUDY OF QUANTUM PHASE DIAGRAM OF
RYDBERG ATOMS WITH REPULSIVE 1/r6 INTERACTION
MOTIVATION
INTERACTION POTENTIAL
MODEL HAMILTONIAN
MONTE CARLO METHODS
GUIDING WAVE FUNCTION
CLASSICAL CRYSTAL
0.000 0.002 0.004 0.006 0.008 0.0103.45
3.50
3.55
3.60
3.65
E / N
BCC FCC HCP
1 / N
QUANTUM ZERO-TEMPERATURE PHASE TRANSITION
8 10 12 14 16200
400
600
800
1000
solidgas
E / E0
gas solid classical FCC solid
r30
transition
TYPICAL NUMBERS
LOW TEMPERATURE
0 1 2 3 4 50
1
2
3
r / r0
g2(r)/2
T/E0=0.2
N = 32 N = 108 N = 864 N = 1372
HIGH TEMPERATURE
0 1 2 3 4 50
1
2
3 T/E0=0.3
N = 32 N = 108 N = 864 N = 1372
g2(r)/2
r / r0
PEAK IN STRUCTURE FACTOR
100 10001
10
100
1000S(k
peak)
N
T/E0 = 0.1
T/E0 = 0.2
T/E0 = 0.22
T/E0 = 0.25
T/E0 = 0.3
T/E0 = 0.4
T/E0 = 0.5
TEMPERATURE GAS-SOLID TRANSITION
3.2 3.4 3.6 3.8 4.00
2
4
6
8
10
p(E)
T=0.20 T=0.21 T=0.22 T=0.23 T=0.24 T=0.25 T=0.26 T=0.27 T=0.28 T=0.29 T=0.30
E
PHASE DIAGRAM
0 5 10 15 200.0
0.1
0.2
0.3
cr3
0 11
TC 0.23 E
0
normal gas
crystalsuperfluid gas
T/E0
r3
0
FCC vs HCP
0 1 2 3 4 5
-2x10-4
0
2x10-4
EFCC
- EHCP
0
WHICH MASS/KINETIC ENERGY?
CONCLUSIONS
THANK YOU VERY MUCH FOR YOUR ATTENTION!
INTERACTION POTENTIAL