Atomic, molecular & optical physics
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- Electron Correlation in Chemical Bonding: From Dispersion to Covalent Stabilization in Prototype Diatomic Systems.
- Limits of Memory-Assisted Coherence in Cavity-Embedded Molecules.
- Dynamics and Energy Relaxation of Formic Acid Dimers Following Inner Valence Ionization.
- How β-Ionone Ring Dynamics and Conformational Heterogeneity Control Carotenoid Photophysics.
- Variational Polaron Theory for Ground States of Strongly Coupled Light-Matter and Electron-Phonon Systems.
- Primary Role of Semi-Local and Exact-Exchange Difference in the Description of Correlation Effects in Hybrid Functionals.
- Resolving the Nature of the Lowest-Frequency Raman Mode of Liquid Water.
- Benchmarking Hierarchical Double-Ended Transition-State Search Methods for Metal-Catalyzed Reactions.
- Testing a Potential Averaging for Quantum Inelastic Dynamics.
- Topology-Controlled Photophysics of Ionized C14H10 Isomers.
- Inducing Enantioselectivity in Radiative Charge-Transfer Rates through Chiral Quantum Electrodynamic Fluctuations.
- A Density-Consistent, Finite van der Waals Potential from Gaussian Atomic Densities.
- Toward a Local Manipulation of DNA by Quantum Fields.
- Nuclear-Electronic Orbital Theory: Exploring Nuclear Quantum Effects in Chemistry, Biology, and Materials.
- A Unified Operator Resolution of Quadratic Bond Orders.
- Dark-State-Mediated Low-Energy Electron Attachment to Molecular Oxygen: Symmetry Adapted Decomposition of the DEA Resonance through Dyson-Orbitals' Incoherent Mixing.
- Interfacial Electric Fields in Water Nanodroplets Are Weakly Dependent on Curvature and pH.
- Microsolvation Controls Ultrafast Relaxation Pathways in Hydrated Pyridine.
- A Theoretical Study of Absorption-Emission Asymmetry from Franck-Condon-Herzberg-Teller Interference and Duschinsky Mixing.
- Mode-Selective and Anharmonicity-Dependent Energy Transport in Cavity-Coupled Water.
- Dimensional Engineering of Co/W Superlattices Enables Out-of-Plane Spin Polarization with 90% Field-Free Switching in Perpendicular CoFeB.
- Bi12Rh3Ag6I9: Mobile Silver Ions and Surface-Dominated Transport in a Layered Weak Topological Insulator.
- Quantifying Viscosity of Semisolid Submicrometer and Nanosized Individual Aerosols Using Atomic Force Microscopy with Varying Cantilever Velocity.
- Interface-Induced Magnetization Reversal and Multistate Magnetoresistance in Fe3GaTe2/Ni80Fe20 Heterostructure
- Influence of External Electric Field on B6C6N6: Focusing on Structure, Electronic Structure, Spectra and Reactivity