Isotope effects in liquid water via deep potential molecular dynamics

Physics & Astronomy

• deep water 100%
• isotope effect 81%
• molecular dynamics 53%
• potential energy 42%
• sampling 41%
• liquids 39%
• conjunction 33%
• machine learning 31%
• water 28%
• radial distribution 25%
• angular distribution 21%
• distribution functions 19%
• density functional theory 19%
• interference 16%
• cross sections 14%
• predictions 13%
• configurations 13%
• atoms 12%
• simulation 9%

Chemical Compounds

• Path Integral 81%
• Isotope Effect 76%
• Molecular Dynamics 55%
• Potential Energy Surface 47%
• Angular Distribution Function 43%
• Langevin Equation 43%
• Sampling 41%
• Radial Distribution Function 30%
• Simulation 15%
• Density Functional Theory 15%
• Liquid 13%

Medicine & Life Sciences

• Molecular Dynamics Simulation 83%
• Isotopes 81%
• Water 50%
• Density Functional Theory 43%
• Machine Learning 28%
• Hot Temperature 19%
• Light 17%