Ultra Accelerated Quantum Chemical Molecular Dynamics Study on Mechanochemical Reaction of Micro-Bubble Induced by Shock Wave

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Mechanochemical reactions and micro-bubble formation may take place in water under strong compression/rarefaction realized by shock waves e.g. generated in collapsing process of laser-induced bubbles. However, elementary processes of the micro-bubble have never been revealed [...]

Multi-level Computational Chemistry Approach for Phase Change Behavior of Water induced by Laser Irradiation

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Recently, laser irradiation involving chemical reaction is particularly interesting in the field related to high-technology material design. In this study, a phenomenon of rapid boiling water induced by infrared laser irradiation was investigated by means [...]