Equilibrium, metastability, and hysteresis in a model spin-crossover material with nearest-neighbor antiferromagnetic-like and long-range ferromagnetic-like interactions
Abstract
Phase diagrams and hysteresis loops were obtained by Monte Carlo simulations and a mean- field method for a simplified model of a spin-crossovermaterialwith a two-step transition between the high-spin and low-spin states. This model is a mapping onto a square-lattice S = 1/2 Ising model with antiferromagnetic nearest-neighbor and ferromagnetic Husimi-Temperley ( equivalent-neighbor) long-range interactions. Phase diagrams obtained by the two methods for weak and strong long-range interactions are found to be similar. However, for intermediate-strength long-range interactions, the Monte Carlo simulations show that tricritical points decompose into pairs of critical end points and mean-field critical points surrounded by horn-shaped regions of metastability. Hysteresis loops along paths traversing the horn regions are strongly reminiscent of thermal two-step transition loops with hysteresis, recently observed experimentally in several spin-crossover materials. As a result, we believe analogous phenomena should be observable in experiments and simulations for many systems that exhibit competition between local antiferromagnetic-like interactions and long-range ferromagnetic-like interactions caused by elastic distortions.
- Authors:
-
- Florida State Univ., Tallahassee, FL (United States)
- Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States)
- The Univ. of Tokyo, Tokyo (Japan); CREST, Saitama (Japan)
- The Univ. of Tokyo, Tokyo (Japan); Univ. of British Columbia, Vancouver, BC (Canada)
- National Institute for Materials Science, Ibaraki (Japan)
- Publication Date:
- Research Org.:
- Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States)
- Sponsoring Org.:
- USDOE
- OSTI Identifier:
- 1412068
- Alternate Identifier(s):
- OSTI ID: 1238095
- Grant/Contract Number:
- AC05-00OR22725
- Resource Type:
- Accepted Manuscript
- Journal Name:
- Physical Review B
- Additional Journal Information:
- Journal Volume: 93; Journal Issue: 6; Journal ID: ISSN 2469-9950
- Publisher:
- American Physical Society (APS)
- Country of Publication:
- United States
- Language:
- English
- Subject:
- 36 MATERIALS SCIENCE
Citation Formats
Rikvold, Per Arne, Brown, Gregory, Miyashita, Seiji, Omand, Conor, and Nishino, Masamichi. Equilibrium, metastability, and hysteresis in a model spin-crossover material with nearest-neighbor antiferromagnetic-like and long-range ferromagnetic-like interactions. United States: N. p., 2016.
Web. doi:10.1103/PhysRevB.93.064109.
Rikvold, Per Arne, Brown, Gregory, Miyashita, Seiji, Omand, Conor, & Nishino, Masamichi. Equilibrium, metastability, and hysteresis in a model spin-crossover material with nearest-neighbor antiferromagnetic-like and long-range ferromagnetic-like interactions. United States. https://doi.org/10.1103/PhysRevB.93.064109
Rikvold, Per Arne, Brown, Gregory, Miyashita, Seiji, Omand, Conor, and Nishino, Masamichi. Tue .
"Equilibrium, metastability, and hysteresis in a model spin-crossover material with nearest-neighbor antiferromagnetic-like and long-range ferromagnetic-like interactions". United States. https://doi.org/10.1103/PhysRevB.93.064109. https://www.osti.gov/servlets/purl/1412068.
@article{osti_1412068,
title = {Equilibrium, metastability, and hysteresis in a model spin-crossover material with nearest-neighbor antiferromagnetic-like and long-range ferromagnetic-like interactions},
author = {Rikvold, Per Arne and Brown, Gregory and Miyashita, Seiji and Omand, Conor and Nishino, Masamichi},
abstractNote = {Phase diagrams and hysteresis loops were obtained by Monte Carlo simulations and a mean- field method for a simplified model of a spin-crossovermaterialwith a two-step transition between the high-spin and low-spin states. This model is a mapping onto a square-lattice S = 1/2 Ising model with antiferromagnetic nearest-neighbor and ferromagnetic Husimi-Temperley ( equivalent-neighbor) long-range interactions. Phase diagrams obtained by the two methods for weak and strong long-range interactions are found to be similar. However, for intermediate-strength long-range interactions, the Monte Carlo simulations show that tricritical points decompose into pairs of critical end points and mean-field critical points surrounded by horn-shaped regions of metastability. Hysteresis loops along paths traversing the horn regions are strongly reminiscent of thermal two-step transition loops with hysteresis, recently observed experimentally in several spin-crossover materials. As a result, we believe analogous phenomena should be observable in experiments and simulations for many systems that exhibit competition between local antiferromagnetic-like interactions and long-range ferromagnetic-like interactions caused by elastic distortions.},
doi = {10.1103/PhysRevB.93.064109},
journal = {Physical Review B},
number = 6,
volume = 93,
place = {United States},
year = {Tue Feb 16 00:00:00 EST 2016},
month = {Tue Feb 16 00:00:00 EST 2016}
}
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Works referenced in this record:
Thermodynamics of the spin transition in [FexZn1−x(2-pic)3]Cl2 · EtOH
journal, February 1992
- Jakobi, R.; Spiering, H.; Gütlich, P.
- Journal of Physics and Chemistry of Solids, Vol. 53, Issue 2
Universal ratio of magnetization moments in two-dimensional Ising models
journal, January 1993
- Kamieniarz, G.; Blote, H. W. J.
- Journal of Physics A: Mathematical and General, Vol. 26, Issue 2
Realization of the mean-field universality class in spin-crossover materials
journal, January 2008
- Miyashita, Seiji; Konishi, Yusuké; Nishino, Masamichi
- Physical Review B, Vol. 77, Issue 1
Critical behavior of an elastic Ising antiferromagnet at constant pressure
journal, September 2005
- Zhu, Xiaoliang; Tavazza, F.; Landau, D. P.
- Physical Review B, Vol. 72, Issue 10
Finite-size scaling analysis of the S=1 Ising model on the triangular lattice
journal, October 1988
- Collins, Joseph B.; Rikvold, Per Arne; Gawlinski, E. T.
- Physical Review B, Vol. 38, Issue 10
Multimetastability, phototrapping, and thermal trapping of a metastable commensurate superstructure in a Fe spin-crossover compound
journal, August 2012
- Pillet, Sébastien; Bendeif, El-Eulmi; Bonnet, Sylvestre
- Physical Review B, Vol. 86, Issue 6
Structure of fluctuations near mean-field critical points and spinodals and its implication for physical processes
journal, March 2007
- Klein, W.; Gould, Harvey; Gulbahce, Natali
- Physical Review E, Vol. 75, Issue 3
Finite-size effects at first-order transitions
journal, November 1983
- Privman, Vladimir; Fisher, Michael E.
- Journal of Statistical Physics, Vol. 33, Issue 2
Unusual spin-transition anomaly in the crossover system [Fe(2-pic)3]Cl2·EtOH
journal, September 1982
- Köppen, H.; Müller, E. W.; Köhler, C. P.
- Chemical Physics Letters, Vol. 91, Issue 5
TRANSITIONS « LOW SPIN »-« HIGH SPIN » DANS LES COMPLEXES DE Fe 2+
journal, February 1971
- Wajnflasz, J.; Pick, R.
- Le Journal de Physique Colloques, Vol. 32, Issue C1
Ordering Phenomena and Phase Transitions in a Spin-Crossover Compound—Uncovering the Nature of the Intermediate Phase of[Fe(2-pic)3]Cl2⋅EtOH
journal, August 2003
- Chernyshov, Dmitry; Hostettler, Marc; Törnroos, Karl W.
- Angewandte Chemie International Edition, Vol. 42, Issue 32
Eigenvalue Problem of Metastability in Macrosystem
journal, September 1976
- Tomita, H.; Ito, A.; Kidachi, H.
- Progress of Theoretical Physics, Vol. 56, Issue 3
The effect of thermal agitaion on atomic arrangement in alloys—II
journal, October 1935
- Bragg, William Lawrence; Williams, Evan James
- Proceedings of the Royal Society of London. Series A - Mathematical and Physical Sciences, Vol. 151, Issue 874, p. 540-566
Simple Two-Dimensional Model for the Elastic Origin of Cooperativity among Spin States of Spin-Crossover Complexes
journal, June 2007
- Nishino, Masamichi; Boukheddaden, Kamel; Konishi, Yusuké
- Physical Review Letters, Vol. 98, Issue 24
A two-step spin crossover mononuclear iron(ii) complex with a [HS–LS–LS] intermediate phase
journal, January 2008
- Bonnet, Sylvestre; Siegler, Maxime A.; Costa, José Sánchez
- Chemical Communications, Issue 43
Magnetic Tricritical Points in Ising Antiferromagnets
journal, February 1972
- Landau, D. P.
- Physical Review Letters, Vol. 28, Issue 7
Tricritical Universality in Two Dimensions
journal, June 1981
- Landau, D. P.; Swendsen, R. H.
- Physical Review Letters, Vol. 46, Issue 22
Thermal and Optical Switching of Iron(II) Complexes
journal, November 1994
- Gütlich, Philipp; Hauser, Andreas; Spiering, Hartmut
- Angewandte Chemie International Edition in English, Vol. 33, Issue 20
Complex free energies and metastable lifetimes
journal, August 1980
- Newman, C. M.; Schulman, L. S.
- Journal of Statistical Physics, Vol. 23, Issue 2
Noncritical interface near a critical end point
journal, January 1977
- Widom, B.
- The Journal of Chemical Physics, Vol. 67, Issue 3
Asymptotic forms and scaling properties of the relaxation time near threshold points in spinodal-type dynamical phase transitions
journal, January 2010
- Mori, Takashi; Miyashita, Seiji; Rikvold, Per Arne
- Physical Review E, Vol. 81, Issue 1
Critical Properties from Monte Carlo Coarse Graining and Renormalization
journal, August 1981
- Binder, K.
- Physical Review Letters, Vol. 47, Issue 9
Critical Binder cumulant in two-dimensional anisotropic Ising models
journal, October 2005
- Selke, W.; Shchur, L. N.
- Journal of Physics A: Mathematical and General, Vol. 38, Issue 44
Nonuniversal finite-size scaling in anisotropic systems
journal, November 2004
- Chen, X. S.; Dohm, V.
- Physical Review E, Vol. 70, Issue 5
Monte Carlo Simulation of Pressure-Induced Phase Transitions in Spin-Crossover Materials
journal, February 2008
- Konishi, Yusuké; Tokoro, Hiroko; Nishino, Masamichi
- Physical Review Letters, Vol. 100, Issue 6
Pressure and Temperature Spin Crossover Sensors with Optical Detection
journal, April 2012
- Linares, Jorge; Codjovi, Epiphane; Garcia, Yann
- Sensors, Vol. 12, Issue 4
Abrupt two-step and symmetry breaking spin crossover in an iron( iii ) complex: an exceptionally wide [LS–HS] plateau
journal, January 2015
- Harding, David J.; Phonsri, Wasinee; Harding, Phimphaka
- Dalton Transactions, Vol. 44, Issue 34
Total free energy of a spin-crossover molecular system
journal, November 2004
- Spiering, H.; Boukheddaden, K.; Linares, J.
- Physical Review B, Vol. 70, Issue 18
Effect of the short-range interaction on critical phenomena in elastic interaction systems
journal, July 2013
- Nishino, Masamichi; Miyashita, Seiji
- Physical Review B, Vol. 88, Issue 1
Nucleation barriers, spinodals, and the Ginzburg criterion
journal, January 1984
- Binder, K.
- Physical Review A, Vol. 29, Issue 1
Critical droplets and metastability for a Glauber dynamics at very low temperatures
journal, April 1991
- Neves, E. Jordão; Schonmann, Roberto H.
- Communications in Mathematical Physics, Vol. 137, Issue 2
The Effect of Thermal Agitation on Atomic Arrangement in Alloys
journal, July 1934
- Bragg, W. L.; Williams, E. J.
- Proceedings of the Royal Society A: Mathematical, Physical and Engineering Sciences, Vol. 145, Issue 855
Two-step spin conversion of [FeII(5-NO2-sal-N(1,4,7,10))]: 292, 153, and 103 K x-ray crystal and molecular structure, infrared, magnetic, Moessbauer, calorimetric, and theoretical studies
journal, January 1994
- Boinnard, Didier; Bousseksou, Azzedine; Dworkin, Ary
- Inorganic Chemistry, Vol. 33, Issue 2
Photoinduced spin transition probed by x-ray diffraction
journal, January 2004
- Huby, Nolwenn; Guérin, Laurent; Collet, Eric
- Physical Review B, Vol. 69, Issue 2
Ising-like model for the two-step spin-crossover
journal, July 1992
- Bousseksou, A.; Nasser, J.; Linares, J.
- Journal de Physique I, Vol. 2, Issue 7
Chemical/Physical Pressure Tunable Spin-Transition Temperature and Hysteresis in a Two-Step Spin Crossover Porous Coordination Framework
journal, August 2012
- Lin, Jian-Bin; Xue, Wei; Wang, Bao-Ying
- Inorganic Chemistry, Vol. 51, Issue 17
Crossover between a short-range and a long-range Ising model
journal, August 2011
- Nakada, Taro; Rikvold, Per Arne; Mori, Takashi
- Physical Review B, Vol. 84, Issue 5
Metastable lifetimes in a kinetic Ising model: Dependence on field and system size
journal, June 1994
- Rikvold, Per Arne; Tomita, H.; Miyashita, S.
- Physical Review E, Vol. 49, Issue 6
Light-induced spin-state switching in the mixed crystal series of the 2D coordination network {[Zn 1−x Fe x (bbtr) 3 ](BF 4 ) 2 } ∞ : optical spectroscopy and cooperative effects
journal, January 2014
- Chakraborty, Pradip; Enachescu, Cristian; Humair, Arnaud
- Dalton Trans., Vol. 43, Issue 47
Landau theory for spin transition and ordering phenomena in Fe(II) compounds
journal, September 2004
- Chernyshov, Dmitry; Bürgi, Hans-Beat; Hostettler, Marc
- Physical Review B, Vol. 70, Issue 9
First-order reversal curves analysis of rate-dependent hysteresis: The example of light-induced thermal hysteresis in a spin-crossover solid
journal, August 2005
- Enachescu, Cristian; Tanasa, Radu; Stancu, Alexandru
- Physical Review B, Vol. 72, Issue 5
Structures of Metastable States in Phase Transitions with a High-Spin Low-Spin Degree of Freedom
journal, October 2005
- Miyashita, S.; Konishi, Y.; Tokoro, H.
- Progress of Theoretical Physics, Vol. 114, Issue 4
Symmetry breaking and light-induced spin-state trapping in a mononuclear complex with the two-step thermal conversion
journal, December 2010
- Buron-Le Cointe, M.; Ould Moussa, N.; Trzop, E.
- Physical Review B, Vol. 82, Issue 21
Classical critical behavior of spin models with long-range interactions
journal, October 1997
- Luijten, Erik; Blöte, Henk W. J.
- Physical Review B, Vol. 56, Issue 14
Two-step spin crossover in the new dinuclear compound [Fe(bt)(NCS)2]2bpym, with bt = 2,2'-bi-2-thiazoline and bpym = 2,2'-bipyrimidine: experimental investigation and theoretical approach
journal, June 1992
- Real, Jose Antonio; Bolvin, Helene; Bousseksou, Azzedine
- Journal of the American Chemical Society, Vol. 114, Issue 12
Fe[5NO2-sal-N(1,4,7,10)]: a new iron(II) complex exhibiting an unusual two-step spin conversion afforded by a hexadentate ligand with a N4O2, donor set
journal, May 1987
- Petrouleas, V.; Tuchagues, J. -P.
- Chemical Physics Letters, Vol. 137, Issue 1
The Neel point for spin-transition systems: toward a two-step transition
journal, November 1996
- Bolvin, Hélène
- Chemical Physics, Vol. 211, Issue 1-3
Finite-size-scaling study of a two-dimensional lattice-gas model with a tricritical point
journal, September 1983
- Rikvold, P. A.; Kinzel, W.; Gunton, J. D.
- Physical Review B, Vol. 28, Issue 5
Spin crossover with thermal hysteresis: practicalities and lessons learnt
journal, January 2015
- Brooker, Sally
- Chemical Society Reviews, Vol. 44, Issue 10
Critical temperature and correlation length of an elastic interaction model for spin-crossover materials
journal, February 2012
- Nakada, Taro; Mori, Takashi; Miyashita, Seiji
- Physical Review B, Vol. 85, Issue 5
Molecular spin crossover phenomenon: recent achievements and prospects
journal, January 2011
- Bousseksou, Azzedine; Molnár, Gábor; Salmon, Lionel
- Chemical Society Reviews, Vol. 40, Issue 6
Threshold phenomena under photoexcitation of spin-crossover materials with cooperativity due to elastic interactions
journal, August 2009
- Miyashita, Seiji; Rikvold, Per Arne; Mori, Takashi
- Physical Review B, Vol. 80, Issue 6
Monte Carlo Studies of the Ising Antiferromagnet with a Ferromagnetic Mean-field Term
journal, January 2014
- Brown, Gregory; Rikvold, Per Arne; Miyashita, Seiji
- Physics Procedia, Vol. 57
Light-induced spin-crossover magnet
journal, June 2011
- Ohkoshi, Shin-ichi; Imoto, Kenta; Tsunobuchi, Yoshihide
- Nature Chemistry, Vol. 3, Issue 7
Growth Dynamics of Photoinduced Phase Domain in Cyano-Complex Studied by Boundary Sensitive Raman Spectroscopy
journal, February 2012
- Asahara, A.; Nakajima, M.; Fukaya, R.
- Acta Physica Polonica A, Vol. 121, Issue 2
Spin-Transition Polymers: From Molecular Materials Toward Memory Devices
journal, January 1998
- Kahn, O.
- Science, Vol. 279, Issue 5347
Symmetry-breaking structural phase transitions in spin crossover complexes
journal, April 2015
- Shatruk, Michael; Phan, Hoa; Chrisostomo, Bruno A.
- Coordination Chemistry Reviews, Vol. 289-290
Evolution of self-organized spin domains under light in single-crystalline
journal, January 2010
- Chong, C.; Varret, F.; Boukheddaden, K.
- Physical Review B, Vol. 81, Issue 1
Works referencing / citing this record:
Cooperative phenomena in spin crossover systems
journal, October 2017
- Nesterov, Alexander I.; Orlov, Yuri S.; Ovchinnikov, Sergey G.
- Physical Review B, Vol. 96, Issue 13
Cooperative Phenomena in Spin Crossover Systems
text, January 2016
- Nesterov, Alexander I.; Orlov, Yuri S.; Ovchinnikov, Sergey G.
- arXiv