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on.edu/molecular-rotations-multiscale-order-hyperuniformity-and-signatures-of-metastability-during-the-compression-decompression-cycles-of-amorphous-ices/</loc><lastmod>2025-08-22T12:02:27-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/significance-of-energy-conservation-in-coupled-trajectory-approaches-to-non-adiabatic-dynamics/</loc><lastmod>2025-08-22T11:54:59-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/yong-wang/</loc><lastmod>2024-04-17T11:05:05-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/ryan-j-szukalo/</loc><lastmod>2024-04-17T11:04:09-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/robing-ph-dependent-dehydration-dynamics-of-mg-and-ca-cations-in-aqueous-solutions-with-multi-level-quantum-mechanics-molecular-dynamics-simulations/</loc><lastmod>2025-08-22T11:45:26-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/a-neural-network-water-model-based-on-the-mb-pol-many-body-potential/</loc><lastmod>2025-08-22T11:42:42-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/resolving-the-mechanisms-of-ca-and-mg-carbonate-ion-pair-formation-with-multi-level-molecular-dynamics-quantum-mechanics-simulations/</loc><lastmod>2025-08-22T11:41:15-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/unravelling-the-origin-of-the-vibronic-spectral-signatures-in-an-excitonically-coupled-indocarbocyanine-cy3-dimer/</loc><lastmod>2025-08-22T11:39:36-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/acid-base-chemistry-of-a-model-iro2-catalytic-interface/</loc><lastmod>2025-08-21T12:57:22-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/modeling-the-aqueous-interface-of-amorphous-tio2-using-deep-potential-molecular-dynamics/</loc><lastmod>2025-08-21T12:55:20-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/elucidating-the-water-anatase-tio2101-interface-structure-using-infrared-signatures-and-molecular-dynamics/</loc><lastmod>2025-08-21T12:52:32-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/probing-the-self-ionization-of-liquid-water-with-ab-initio-deep-potential-molecular-dynamics/</loc><lastmod>2025-08-21T12:50:47-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/ab-initio-generalized-langevin-equation-2/</loc><lastmod>2025-08-21T12:49:02-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/yupei-zhang/</loc><lastmod>2024-04-17T10:59:59-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/exploring-the-impact-of-ions-on-oxygen-k-edge-x-ray-absorption-spectroscopy-in-nacl-solution-using-the-gw-bethe-salpeter-equation-approach/</loc><lastmod>2025-08-21T12:47:09-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/nonadiabatic-dynamics-with-classical-trajectories-the-problem-of-an-initial-coherent-superposition-of-electronic-states/</loc><lastmod>2025-08-21T12:43:04-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/exact-factorization-based-surface-hopping-without-velocity-adjustment/</loc><lastmod>2025-08-21T12:39:59-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/molecular-simulation-of-lithium-carbonate-reactive-vapor-liquid-equilibria-using-a-deep-potential-model/</loc><lastmod>2025-08-21T12:20:03-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/modeling-bicarbonate-formation-in-an-alkaline-solution-with-multi-level-quantum-mechanics-molecular-dynamics-simulations/</loc><lastmod>2025-08-21T12:00:23-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/molecular-dynamical-and-quantum-mechanical-exploration-of-the-site-specific-dynamics-of-cy3-dimers-internally-linked-to-dsdna/</loc><lastmod>2025-08-21T11:27:51-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/understanding-strain-and-failure-of-a-knot-in-polyethylene-using-molecular-dynamics-with-machine-learned-potentials/</loc><lastmod>2025-08-21T11:41:09-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/zheng-yu/</loc><lastmod>2024-07-09T15:59:53-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/thermodynamic-driving-forces-in-contact-electrification-between-polymeric-materials/</loc><lastmod>2025-08-21T11:25:53-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/aqueous-titania-interfaces/</loc><lastmod>2025-08-21T11:24:46-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/anti-coulomb-interaction-between-charges-in-a-dielectric-medium/</loc><lastmod>2025-08-21T12:37:14-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/molecular-scale-insights-into-the-electrical-double-layer-at-oxide-electrolyte-interfaces/</loc><lastmod>2025-08-21T12:35:33-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/enhanced-deep-potential-model-for-fast-and-accurate-molecular-dynamics-application-to-the-hydrated-electron/</loc><lastmod>2025-08-21T12:10:10-04:00</lastmod></url><url><loc>https://ccsc.princeton.edu/coarse-graining-conformational-dynamics-with-multidimensional-generalized-langevin-equation-how-when-and-why/</loc><lastmod>2025-08-21T12:02:43-04:00</lastmod></url><url><lo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