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Molecular dynamics simulation<br><br>Liquid/vapor interfacial structure of neat polar liquids<br><br>Density profile<br><br>Orientational analysis<br><br>Orientational distribution map (1)
Molecular dynamics simulations (1)
Molecular simulation (1)
orientation (1)
Oxovanadium (IV) (1)
Oxovanadium(IV)<br><br>Formation constants <br><br>Thermodynamics <br><br>Ab initio calculations <br><br>Antioxidant (1)
Oxovanadium(IV)<br><br>Formation constants<br><br>Thermodynamic<br><br>Ab initio calculations (1)
Partial charges (1)
Physisorption on circumcoronene (1)
Physisorption<br><br>Hydrophobic and Hydrophilic imidazolium Ionic Liquids<br><br>Graphite Plate Surface<br><br>Quantum chemical computation<br><br>Microscopic adsorption structure (1)