Efficient sampling of ice structures by electrostatic switching

Engineering & Materials Science

• Electrostatics 100%
• Ice 95%
• Sampling 65%
• Permittivity 47%
• Water 38%
• Temperature 37%
• Hydrogen bonds 32%
• Defects 32%
• Protons 28%

Physics & Astronomy

• ice 91%
• sampling 78%
• electrostatics 71%
• configurations 50%
• water 40%
• permittivity 32%
• defects 26%
• hydrogen bonds 24%
• temperature 20%
• dipoles 17%
• protons 15%

Chemical Compounds

• Sampling 77%
• Dielectric Constant 42%
• Canonical Ensemble 35%
• Dipole 23%
• Error 17%
• Proton 15%
• Hydrogen Bond 14%