Work

DFTB-MD Simulations and Quantum Chemical Investigations of Reaction Mechanisms of Water-Reactive Molecules (SiH 2 Cl 2 , PCl 3 , and SOCl 2 )

Year: 2026

Type: article

Source: The Journal of Physical Chemistry A

DOI: 10.1021/acs.jpca.5c07535

Authors: Wonil Seo, Jeongmin Park, Ingyeong Kim, Yurim Jin, Eunji Park, Jungyoon Kim, Jungyoon Kim, Joonghan Kim, Joonghan Kim

Institution: Catholic University of Korea

Language: English

Topic: Advanced Chemical Physics Studies

Subfield: Atomic and Molecular Physics, and Optics

Field: Physics and Astronomy

Domain: Physical Sciences

Open Access status: closed

Funders: Ministry of Trade, Industry and Energy, Korea Institute of Energy Technology Evaluation and Planning

Award: G19098631

OpenAlex ID: W7127965019

FWCI:

Cites: 50

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