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arXiv · 2504.09780

An Interoperable Syntax for Gas Scattering Reaction Definition

Dan Andrei Ciubotaru·Michele Renda·Călin Alexa
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Abstract

We propose a unified, human-readable, machine-processable novel syntax/notation designed to comprehensively describe reactions, molecules and excitation states. Our notation resolves inconsistencies in existing data representations and facilitates seamless integration with computational tools. We define a structured syntax for molecular species, excitation states, and reaction mechanisms, ensuring compatibility with a wide range of scientific applications. We provide a reference implementation based on Parsing Expression Grammar syntax, enabling automated parsing and interpretation of the proposed notation. This work is available as an open-source project, enabling validation and fostering its adoption and further improvement by the scientific community. Our standardized framework provides gas scattering models with increased interoperability and accuracy.

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Dan Andrei Ciubotaru, Michele Renda, Călin Alexa. 2025-04-14. An Interoperable Syntax for Gas Scattering Reaction Definition. https://arxiv.org/abs/2504.09780

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