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Pressure-induced phase transitions of spin-crossover materials were simulatedby a Monte Carlo simulation in the constant pressure ensemble for the firsttime. Here, as the origin of the cooperative interaction, we adopt elasticinteraction among the distortions of the lattice due to the difference of themolecular sizes in different spin states, i.e., the high spin (HS) state andthe low spin (LS) state. We studied how the temperature dependence of theordering process changes with the pressure, and we obtained a standard sequenceof temperature dependences that has been found in changing other parameterssuch as strength of the ligand field (S. Miyashita et al., Prog. Theor. Phys.\textbf{114}, 719 (2005)). Various effects of pressure on the spin-crossoverordering process are examined from a unified point of view.

Monte Carlo simulation of pressure-induced phase transitions in spin-crossover materials