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Updated: Aug 9, 2025

Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry
Published on: April 8, 2020
Combinatorics and Statistical Mechanics of Integer Partitions.
1Department of Chemical Engineering, Pennsylvania State University, State College, PA 16801, USA.
Integer partitions form a thermodynamic probability space. Ordered partitions, viewed as cluster masses, can generate any distribution via a novel stochastic process and selection functional.
Area of Science:
- Combinatorics
- Statistical Mechanics
- Probability Theory
Background:
- Integer partitions are studied as a probability space.
- Ordered partitions represent configurations of cluster masses.
- The asymptotic limit reveals thermodynamic behavior.
Purpose of the Study:
- To establish integer partitions as a thermodynamic probability space.
- To define a selection functional for probability measure on distributions.
- To demonstrate thermodynamic properties and construct a sampling method.
Main Methods:
- Organizing ordered partitions into microcanonical and canonical ensembles.
- Defining a selection functional and studying combinatorial properties.
- Constructing an exchange reaction stochastic process for Monte Carlo simulation.
Main Results:
- The space of integer partitions exhibits thermodynamic properties in the asymptotic limit.
- A selection functional can establish a probability measure on distributions.
- Any distribution can be achieved as an equilibrium distribution with appropriate functional choice.
Conclusions:
- Integer partitions can be modeled as a thermodynamic system.
- The exchange reaction process effectively samples mean distributions.
- The framework allows for flexible control over equilibrium distributions.
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