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Home » paper_under_review » Molecular Dynamical and Quantum Mechanical Exploration of the Site-Specific Dynamics of Cy3 dimers internally linked to dsDNA

paper_under_review

Molecular Dynamical and Quantum Mechanical Exploration of the Site-Specific Dynamics of Cy3 dimers internally linked to dsDNA

by Clarice Gethers-Mubarak|Published May 23, 2024

Mohammed I. Sorour, Kurt A. Kistler, Andrew H. Marcus, Spiridoula Matsika. Submitted J. Phys. Chem. B (May 2024)

Electronic Coherences in Molecules: The Projected Nuclear Quantum Momentum as a Hidden Agent

Villaseco Arribas, N.T. Maitra, arXiv: 2405.00649, submitted (2024)

Published June 15, 2021

Using differentiable programming to obtain an energy and density-optimized exchange-correlation functional

Sebastian dick and Marivi Fernandez-Serra, submitted to Phys. Rev. Lett. (2021)

Published July 22, 2024

Deuteration removes dipolar defects from KDP crystals

B. Yang, P. Chen, R. Car, arXiv: 2404.08125, submitted to npj.compmat (2024)

Published May 23, 2024

Universal Dispersion Corrections for Machine-Learned Potentials

Mark DelloStritto and Michael Klein, The Journal of Physical Chemistry, submitted (2024)

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