Lv4
610 积分 2021-11-29 加入
Tunable Ultrafast Charge Transfer across Homojunction Interface
11小时前
已完结
Charge Density Evolution Governing Interfacial Friction
11小时前
已完结
PhysNet: A Neural Network for Predicting Energies, Forces, Dipole Moments, and Partial Charges
8天前
已完结
Bonding Mechanisms Underpinning Structural and Electronic Properties of Halide Perovskites
10天前
已完结
Electronic Shannon Entropy as an Effective Descriptor of Nonradiative Dynamics in Dense Manifolds of Excited States: Case Study of C 20 , C 60 , C 70 , C 76 , C 84 , C 86 , and C 90 Fullerenes
12天前
已完结
Rapid Prediction of Hot-Carrier Relaxation by Learning of Nonadiabatic Hamiltonians with Graph Neural Networks
12天前
已完结
Deterministic and efficient switching of sliding ferroelectrics
13天前
已完结
H 2 O Deprotonation Promotes Hole Transfer at the Anatase TiO 2 (001)/Water Interface: First-Principles Molecular Dynamics
13天前
已完结
From solvation to sorption: a comprehensive molecular dynamics study of mefenamic acid conformer behavior in pure scCO2 and scCO2/cellobiose systems
17天前
已完结
N8− Polynitrogen Stabilized on Multi‐Wall Carbon Nanotubes for Oxygen‐Reduction Reactions at Ambient Conditions
19天前
已完结
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