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Aqueous environment
2
Condensed matter physics
2
Condensed matter system
DFT
2
Dimers
2
Machinery
2
Mechanics
2
Molecular dynamics
2
Molecular dynamics simulations
2
Molecular mechanics
2
Periodic boundary conditions
2
Phase interfaces
2
QM-MM
2
Quantum theory
2
Solid-liquid interfaces
2
Titanium dioxide
2
Vibrational dynamics
2
intefaces
2
molecular dynamics
2
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