1978The Journal of Chemical PhysicsRequires access

Monte Carlo calculations of the number of ways to pack nonoverlapping rods on a square lattice

Frank L. McCrackin

Open publisher page 21 citations

Abstract

The number of configurations of nonoverlapping rods on a square lattice is computed for various packing fractions and orientations of the rods. From the number of configurations, the entropies of the configurations are computed and compared with the results of approximate formulas of DiMarzio that are much used in statistical–mechanical theories of liquid crystals. For rods of three lattice sites, our calculations and Dimarzio’s formulas agree to within 0.5% for packing fractions less than 0.5. Some calculations for rods of ten lattice sites also showed good agreement.

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What this paper is about

The number of configurations of nonoverlapping rods on a square lattice is computed for various packing fractions and orientations of the rods. From the number of configurations, the entropies of the configurations are computed and compared with the results of approximate formulas of DiMarzio that are much used in statistical–mechanical theories of liquid crystals. For rods of three lattice sites, our calculations and Dimarzio’s formulas agree to within 0.5% for packing fractions less than 0.5. Some calculations for rods of ten lattice sites also showed good agreement.

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Available abstract

The number of configurations of nonoverlapping rods on a square lattice is computed for various packing fractions and orientations of the rods. From the number of configurations, the entropies of the configurations are computed and compared with the results of approximate formulas of DiMarzio that are much used in statistical–mechanical theories of liquid crystals. For rods of three lattice sites, our calculations and Dimarzio’s formulas agree to within 0.5% for packing fractions less than 0.5. Some calculations for rods of ten lattice sites also showed good agreement.

Key concepts: Rod, Square lattice, Monte Carlo method, Lattice (music), Square (algebra), Condensed matter physics, Statistical physics, Materials science

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