Path integral molecular dynamics framework for spin-phonon systems
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Capsid stabilization reprograms the nuclear fate of the HIV genome.
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Evolution of the energy landscape for n-alkanes: n-C14H30 to n-C20H42
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Origin of exponential operator growth in Hilbert space.
Physical Review Letters
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Nonreciprocal dynamics with weak noise: Aperiodic “Escher cycles” and their quasipotential landscape
Physical Review E
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Compositional control of FUS condensate ageing through aggregation-prone interaction networks
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Molecular and ion sieving with angstrom-channels: general discussion.
Faraday Discuss
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Fast and Accurate Foundation Models for Equivariant Machine-Learned Interatomic Potentials
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Quantum Enhancement of Microcanonical Negative Heat Capacity Features in the Melting of Water Clusters
J Phys Chem Lett
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Avalanche-like intercalation and intraparticle correlations in graphite
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Nonequilibrium pathways between cluster morphologies in active phase separation: Necking, rupture, and cavitation
Physical Review E
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Long-range machine learning of electron density for twisted bilayer moiré materials
PRX Intelligence
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Nodal Error behind Discrepancies between Coupled Cluster and Diffusion Monte Carlo
Journal of chemical theory and computation
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22
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Self-assembly: From blueprints to breakthroughs
Journal of Chemical Physics
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Effective classical potential for quantum statistical averages
Physical Review E
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On environmental science computational labs
Chemical Engineering Journal
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When Cubic is Not Isotropic: Phonon–Exciton Decoupling in CuInSnS4 Single Crystals
Advanced Optical Materials
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How reactive is water at the nanoscale and how to control it?
Science Advances
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A Spectrum of Free Energy Landscape Topologies Encodes Chromatin Polymorphism and Phase Separation
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Hydrodynamic theory of wetting by active particles.
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Controlling the phase behaviour of ultraconfined water via bilayer graphene stacking
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