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A Reaction Dataset for Interstellar Molecules via Global Exploration of Isomerization Pathways and Dissociation Channels: HNCNH, HC3N, c-C3H2, H2CNH, HCOOH, and H2C2O

Year: 2024

Type: article

Abstract: This dataset includes single-point calculation results, conformational exploration outcomes, and coordinates for all EQ, TS, and DC structures used in A Reaction Dataset for Interstellar Molecules via Global Exploration of Isomerization Pathways and Dissociation Channels: HNCNH, HC3N, c-C3H2, H2CNH, HCOOH, and H2C2O. New version is Navigating Chemical Space Through Isomerization Networks and Intermolecular Encounters of Seven Five-Atom Organic Species, via https://doi.org/10.5281/zenodo.16960327

Source: Zenodo (CERN European Organization for Nuclear Research)

DOI: 10.5281/zenodo.14554145

Author: Zhang, Dapeng

Institution: Tohoku University

Language: English

Topic: Astrophysics and Star Formation Studies

Subfield: Astronomy and Astrophysics

Field: Physics and Astronomy

Domain: Physical Sciences

Open Access status: green

OpenAlex ID: W6967710222

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