Topological approach to microcanonical thermodynamics and phase transition of interacting classical spins

We propose a topological approach suitable to establish a connection between thermodynamics and topology in the microcanonical ensemble. Indeed, we report on results that point to the possibility of describing {\it interacting classical spin systems} in the thermodynamic limit, including the occurrence of a phase transition, using topology arguments only. Our approach relies on Morse theory, through the determination of the critical points of the potential energy, which is the proper Morse function. Our main finding is to show that, in the context of the studied classical models, the Euler characteristic $\chi(E)$ embeds the necessary features for a correct description of several magnetic thermodynamic quantities of the systems, such as the magnetization, correlation function, susceptibility, and critical temperature. Despite the classical nature of the studied models, such quantities are those that do not violate the laws of thermodynamics [with the proviso that Van der Waals loop states are mean field (MF) artifacts]. We also discuss the subtle connection between our approach using the Euler entropy, defined by the logarithm of the modulus of $\chi(E)$ per site, and that using the {\it Boltzmann} microcanonical entropy. Moreover, the results suggest that the loss of regularity in the Morse function is associated with the occurrence of unstable and metastable thermodynamic solutions in the MF case. The reliability of our approach is tested in two exactly soluble systems: the infinite-range and the short-range $XY$ models in the presence of a magnetic field. In particular, we confirm that the topological hypothesis holds for both the infinite-range ($T_c \neq 0$) and the short-range ($T_c = 0$) $XY$ models. Further studies are very desirable in order to clarify the extension of the validity of our proposal.

[1]  Scaling for interfacial tensions near critical endpoints. , 2004, Physical review. E, Statistical, nonlinear, and soft matter physics.

[2]  D. Mehta,et al.  Energy-landscape analysis of the two-dimensional nearest-neighbor φ⁴ model. , 2012, Physical review. E, Statistical, nonlinear, and soft matter physics.

[3]  Euler–Poincaré characteristic and phase transition in the Potts model on , 2001, cond-mat/0112482.

[4]  Jerome K. Percus,et al.  Thermodynamic properties of small systems , 1961 .

[5]  Paolo Grinza,et al.  Topological origin of the phase transition in a model of DNA denaturation. , 2003, Physical review letters.

[6]  Martin J. Klein,et al.  Negative Absolute Temperatures , 1956 .

[7]  S. Ruffo,et al.  Clustering and relaxation in Hamiltonian long-range dynamics. , 1995, Physical review. E, Statistical physics, plasmas, fluids, and related interdisciplinary topics.

[8]  Marco Pettini,et al.  Topological signature of first-order phase transitions in a mean-field model , 2003 .

[9]  M. Fisher,et al.  LETTER TO THE EDITOR: The shape of the van der Waals loop and universal critical amplitude ratios , 1998 .

[10]  Dhagash Mehta,et al.  Exploring the energy landscape of XY models , 2012, 1211.4800.

[11]  M. Fisher Magnetism in One-Dimensional Systems—The Heisenberg Model for Infinite Spin , 1964 .

[12]  Phase transitions from saddles of the potential energy landscape. , 2007, Physical review letters.

[13]  Relationship between phase transitions and topological changes in one-dimensional models. , 2005, Physical review. E, Statistical, nonlinear, and soft matter physics.

[14]  M. Coutinho-Filho,et al.  Quantum rotors on the AB2 chain with competing interactions , 2009, 1602.05383.

[15]  M. Farber,et al.  TELESCOPIC LINKAGES AND A TOPOLOGICAL APPROACH TO PHASE TRANSITIONS , 2010, Journal of the Australian Mathematical Society.

[16]  N. A. Lurie,et al.  Classical one-dimensional Heisenberg magnet in an applied field , 1975 .

[17]  F. A. N. Santos,et al.  Topological and geometrical aspects of phase transitions , 2014 .

[18]  G. Viswanathan,et al.  Perspectives and Challenges in Statistical Physics and Complex Systems for the Next Decade , 2014 .

[19]  Control of local relaxation behavior in closed bipartite quantum systems. , 2005, Physical review. E, Statistical, nonlinear, and soft matter physics.

[20]  Pierre Schapira,et al.  Operations on constructible functions , 1991 .

[21]  S. Mandt,et al.  Equilibration rates and negative absolute temperatures for ultracold atoms in optical lattices. , 2010, Physical review letters.

[22]  J. Rehn,et al.  Combinatorial and Topological Analysis of the Ising Chain in a Field , 2012 .

[23]  M. Kastner,et al.  Nonanalyticities of the entropy induced by saddle points of the potential energy landscape , 2008, 0803.1550.

[24]  久保 亮五,et al.  Statistical mechanics : an advanced course with problems and solutions , 2005 .

[25]  Hiroshi Ichimura,et al.  Statistical mechanics,: An advanced course with problems and solutions , 1965 .

[26]  O. Penrose,et al.  Rigorous treatment of metastable states in the van der Waals-Maxwell theory , 1971 .

[27]  T. Oka,et al.  Dynamical band flipping in fermionic lattice systems: an ac-field-driven change of the interaction from repulsive to attractive. , 2010, Physical review letters.

[28]  E. Raposo,et al.  Ising and Heisenberg models on ferrimagnetic AB2 chains , 2002 .

[29]  S. S. Hodgman,et al.  Negative Absolute Temperature for Motional Degrees of Freedom , 2012, Science.

[30]  Edward M. Purcell,et al.  A Nuclear Spin System at Negative Temperature , 1951 .

[31]  R. Franzosi,et al.  On the apparent failure of the topological theory of phase transitions , 2016, 1602.01240.

[32]  Yuliy Baryshnikov,et al.  Target Enumeration via Euler Characteristic Integrals , 2009, SIAM J. Appl. Math..

[33]  Víctor Romero-Rochín,et al.  Nonexistence of equilibrium states at absolute negative temperatures. , 2013, Physical review. E, Statistical, nonlinear, and soft matter physics.

[34]  Anti-Shielding Effect and Negative Temperature in Instantaneously Reversed Electric Fields and Left-Handed Media , 2003, cond-mat/0302351.

[35]  Dark energy and supermassive black holes , 2004, astro-ph/0408450.

[36]  Dhagash Mehta,et al.  Stationary point analysis of the one-dimensional lattice Landau gauge fixing functional, aka random phase XY Hamiltonian , 2010, 1010.5335.

[37]  Thermal time scales in a color glass condensate , 2005, hep-ph/0505199.

[38]  Dhagash Mehta,et al.  Phase transitions detached from stationary points of the energy landscape. , 2011, Physical review letters.

[39]  CNRS,et al.  Statistical mechanics and dynamics of solvable models with long-range interactions , 2009, 0907.0323.

[40]  Topology and phase transitions I. Preliminary results , 2007 .

[41]  J. Langer,et al.  Relaxation Times for Metastable States in the Mean-Field Model of a Ferromagnet , 1966 .

[42]  Joel L. Lebowitz,et al.  Macroscopic laws, microscopic dynamics, time's arrow and Boltzmann's entropy , 1993 .

[43]  Marco Pettini,et al.  Topology and phase transitions: from an exactly solvable model to a relation between topology and thermodynamics. , 2005, Physical review. E, Statistical, nonlinear, and soft matter physics.

[44]  D. Gross,et al.  Microcanonical Thermodynamics: Phase Transitions in 'Small' Systems , 2001 .

[45]  Domain statistics in a finite Ising chain. , 2005, Physical review. E, Statistical, nonlinear, and soft matter physics.

[46]  Michael Kastner,et al.  Phase transitions induced by saddle points of vanishing curvature. , 2007, Physical review letters.

[47]  Yuliy Baryshnikov,et al.  Euler integration over definable functions , 2009, Proceedings of the National Academy of Sciences.

[48]  C. Clementi,et al.  GEOMETRY OF DYNAMICS, LYAPUNOV EXPONENTS, AND PHASE TRANSITIONS , 1997, chao-dyn/9702011.

[49]  Roberto Franzosi,et al.  Persistent homology analysis of phase transitions. , 2016, Physical review. E.

[50]  R. Palais,et al.  Critical Point Theory and Submanifold Geometry , 1988 .

[51]  A. Mosk Atomic gases at negative kinetic temperature. , 2005, Physical review letters.

[52]  Nicholas M. Patrikalakis,et al.  Shape Interrogation for Computer Aided Design and Manufacturing , 2002, Springer Berlin Heidelberg.

[53]  A. De Pasquale,et al.  Phase transitions and metastability in the distribution of the bipartite entanglement of a large quantum system , 2009, 0911.3888.

[54]  Marco Pettini,et al.  Phase Transitions and Topology Changes in Configuration Space , 2003 .

[55]  Unattainability of a purely topological criterion for the existence of a phase transition for nonconfining potentials. , 2004, Physical review letters.

[56]  Michael Kastner Phase transitions and configuration space topology , 2008 .

[57]  Stefan Hilbert,et al.  Phase transitions in small systems: Microcanonical vs. canonical ensembles , 2006 .

[58]  Norman F. Ramsey,et al.  Thermodynamics and Statistical Mechanics at Negative Absolute Temperatures , 1956 .

[59]  Roberto Franzosi,et al.  0 30 50 32 v 1 1 5 M ay 2 00 3 Topology and Phase Transitions : Theorem on a necessary relation , 2005 .

[60]  L. Casetti,et al.  Energy landscape and phase transitions in the self-gravitating ring model. , 2009, Physical review. E, Statistical, nonlinear, and soft matter physics.

[61]  Oleg Viro,et al.  Some integral calculus based on Euler characteristic , 1988 .

[62]  Stefan Hilbert,et al.  Consistent thermostatistics forbids negative absolute temperatures , 2013, Nature Physics.

[63]  F. Santos,et al.  Topology, symmetry, phase transitions, and noncollinear spin structures. , 2009, Physical review. E, Statistical, nonlinear, and soft matter physics.

[64]  Topology and phase transitions: paradigmatic evidence , 1999, Physical review letters.

[65]  H. Stanley,et al.  Exact Solution for a Linear Chain of Isotropically Interacting Classical Spins of Arbitrary Dimensionality , 1969 .

[66]  R. Franzosi,et al.  Theorem on the origin of phase transitions. , 2003, Physical Review Letters.