The Multi-Layer Multi-Configuration Time-Dependent Hartree Method for Bosons: Theory, Implementation and Applications

作者: Peter Schmelcher , Sven Krönke , Lushuai Cao , Oriol Vendrell

DOI: 10.1063/1.4821350

关键词: BosonDouble-well potentialPermutationQuantum dynamicsHartreeStatistical physicsMulti-configuration time-dependent HartreeQuantum tunnellingPhysicsSymmetry (physics)Quantum mechanics

摘要: We develop the multi-layer multi-configuration time-dependent Hartree method for bosons (ML-MCTDHB), a variational numerically exact ab-initio studying quantum dynamics and stationary properties of bosonic systems. ML-MCTDHB takes advantage permutation symmetry identical bosons, which allows investigations from few to many-body Moreover, feature enables describe mixed systems consisting arbitrary many species. Multi-dimensional as well mixed-dimensional can be accurately efficiently simulated via expansion scheme. provide detailed account underlying theory corresponding implementation. also demonstrate superior performance by applying tunneling ensembles in one-dimensional double potential, where single-species ensemble various correlation strengths weakly interacting two-species are considered.

参考文章(46)
John C. Light, Tucker Carrington, Discrete-Variable Representations and their Utilization Advances in Chemical Physics. pp. 263- 310 ,(2007) , 10.1002/9780470141731.CH4
Alexej I. Streltsov, Ofir E. Alon, Lorenz S. Cederbaum, Swift loss of coherence of soliton trains in attractive Bose-Einstein condensates. Physical Review Letters. ,vol. 106, pp. 240401- ,(2011) , 10.1103/PHYSREVLETT.106.240401
Alexej I. Streltsov, Ofir E. Alon, Lorenz S. Cederbaum, Role of excited states in the splitting of a trapped interacting Bose-Einstein condensate by a time-dependent barrier. Physical Review Letters. ,vol. 99, pp. 030402- ,(2007) , 10.1103/PHYSREVLETT.99.030402
Alexej I. Streltsov, Ofir E. Alon, Lorenz S. Cederbaum, General mapping for bosonic and fermionic operators in Fock space Physical Review A. ,vol. 81, pp. 022124- ,(2010) , 10.1103/PHYSREVA.81.022124
Ofir E. Alon, Alexej I. Streltsov, Kaspar Sakmann, Axel U.J. Lode, Julian Grond, Lorenz S. Cederbaum, Recursive formulation of the multiconfigurational time-dependent Hartree method for fermions, bosons and mixtures thereof in terms of one-body density operators Chemical Physics. ,vol. 401, pp. 2- 14 ,(2012) , 10.1016/J.CHEMPHYS.2011.09.026
H.-D. Meyer, U. Manthe, L.S. Cederbaum, The multi-configurational time-dependent Hartree approach Chemical Physics Letters. ,vol. 165, pp. 73- 78 ,(1990) , 10.1016/0009-2614(90)87014-I
Parvis Soltan-Panahi, Dirk-Sören Lühmann, Julian Struck, Patrick Windpassinger, Klaus Sengstock, Quantum phase transition to unconventional multi-orbital superfluidity in optical lattices Nature Physics. ,vol. 8, pp. 71- 75 ,(2012) , 10.1038/NPHYS2128
Mauricio Trujillo-Martinez, Anna Posazhennikova, Johann Kroha, Nonequilibrium Josephson oscillations in Bose-Einstein condensates without dissipation. Physical Review Letters. ,vol. 103, pp. 105302- 105302 ,(2009) , 10.1103/PHYSREVLETT.103.105302
M. Nest, R. Padmanaban, P. Saalfrank, Time-dependent approach to electronically excited states of molecules with the multiconfiguration time-dependent Hartree-Fock method. Journal of Chemical Physics. ,vol. 126, pp. 214106- 214106 ,(2007) , 10.1063/1.2743007
Haobin Wang, Michael Thoss, Multilayer formulation of the multiconfiguration time-dependent Hartree theory Journal of Chemical Physics. ,vol. 119, pp. 1289- 1299 ,(2003) , 10.1063/1.1580111