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Molecular Possibility Collapse Theory

Jincheng Zhang

Published Aug 21, 2026• 0 citations
Publisher

Abstract

The Molecular Possibility Collapse Theory (MPCT) proposes a novel framework for understanding chemical reaction pathways and structural formation. It draws an analogy with quantum measurement, suggesting that molecules initially exist within a vast 'possibility space' of potential configurations. As a system evolves, driven by thermodynamic forces and energetic considerations, this possibility space undergoes a 'collapse' towards a single, stable structure. This collapse isn't a random event, but rather a directed process governed by the minimization of energy and the maximization of stability. The theory emphasizes the role of potential energy surfaces (PES) and the concept of 'collapse points' – specific regions within the PES where the probability of structural formation becomes overwhelmingly dominant. The core principle is that the observed structure is not simply the lowest energy state, but the state resulting from the most probable collapse of the initial possibility space. This theory offers a potentially unifying explanation for seemingly disparate phenomena in chemical kinetics, thermodynamics, and molecular recognition. The theoretical framework presented here outlines the key postulates, mathematical formalisms, and potential applications of MPCT.

DOI
10.5281/zenodo.22038668

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The Molecular Possibility Collapse Theory (MPCT) proposes a novel framework for understanding chemical reaction pathways and structural formation. It draws an analogy with quantum measurement, suggesting that molecules initially exist within a vast 'possibility space' of potential configurations. As a system evolves, driven by thermodynamic forces and energetic considerations, this possibility space undergoes a 'collapse' towards a single, stable structure. This collapse isn't a random event, but rather a directed process governed by the minimization of energy and the maximization of stability. The theory emphasizes the role of potential energy surfaces (PES) and the concept of 'collapse points' – specific regions within the PES where the probability of structural formation becomes overwhelmingly dominant. The core principle is that the observed structure is not simply the lowest energy state, but the state resulting from the most probable collapse of the initial possibility space. This theory offers a potentially unifying explanation for seemingly disparate phenomena in chemical kinetics, thermodynamics, and molecular recognition. The theoretical framework presented here outlines the key postulates, mathematical formalisms, and potential applications of MPCT.
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Transition state theory was introduced in 1930s to account for chemical reactions. Central to this theory is the idea of a potential energy surface (PES). It was assumed that such a surface could be constructed using eigensolutions of the Schrödinger equation for the molecular (Coulomb) Hamiltonian but at that time such calculations were not possible. Nowadays quantum mechanical ab initio electronic structure calculations are routine and from their results PESs can be constructed which are believed to approximate those assumed derivable from the eigensolutions. It is argued here that this belief is unfounded. It is suggested that the potential energy surface construction is more appropriately regarded as a legitimate and effective modification of quantum mechanics for chemical purposes.
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