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molecular thermodynamics
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Molecular Thermodynamics of Phases
1933 - 1945
During the 1933–1945 window, molecular thermodynamics shifted toward integrating statistical mechanics with condensed-phase behavior, yielding a cohesive molecular‑level framework for phase phenomena. The era produced region‑based dielectric treatments, rigorous phase‑integral formalisms, lattice models for polymers, and universal state descriptions that connect microscopic interactions with macroscopic properties. As a result, researchers established a practical, predictive paradigm that linked internal molecular motion, local structure, and phase behavior across diverse substances.
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Gradient-Based Interfacial Thermodynamics
1946 - 1963
Molecular Thermodynamics of Fluids
1964 - 1970
Group-Contribution and Simulation Thermodynamics
1971 - 1977
Nosé–Hoover Thermostatted Molecular Dynamics
1978 - 1988
Constant-Pressure Molecular Dynamics
1989 - 1995
Molecular to Mesoscopic Thermodynamics
1996 - 2004
Solvation-Driven Molecular Thermodynamics
2005 - 2011
Dispersion-Driven Solvation Thermodynamics
2012 - 2024