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Earth, Space, and Environmental Chemistry

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Physical Chemistry

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Theoretical and Computational Chemistry

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zero-point energy

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3 results in Keywords: zero-point energy

Physical Chemistry

Quantum-Induced Symmetry-Breaking in the Deuterated Dihydroanthracenyl Radical

Olha Krechkivska, Callan Wilcox, Klaas Nauta, Scott Kable, Timothy Schmidt

Version 1 posted 15 May 2019

461

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Physical Chemistry

The Effect of Zero-Point Energy in Simulating Organic Reactions with Post-Transition State Bifurcation

Matthew Tremblay, Zhongyue John Yang

Version 1 posted 25 October 2021

249

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Theoretical and Computational Chemistry

A Hessian free method to prevent zero-point energy leakage in classical trajectory simulation

Saikat Mukherjee, Mario Barbatti

Version 1 posted 05 January 2022

346

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