Application of the electrostatically embedded many-body expansion to microsolvation of ammonia in water clusters

Chemical Compounds

• Ammonia 71%
• Molecular Cluster 61%
• Wave Function 54%
• Tetramer 46%
• Energy 44%
• Error 35%
• Additive 31%
• Application 29%
• Monomer 27%
• Oligomer 18%
• Electronic State 17%
• Simulation 14%
• Density Functional Theory 14%
• Chemistry 13%
• Purity 11%

Physics & Astronomy

• ammonia 95%
• expansion 58%
• water 53%
• approximation 49%
• deviation 38%
• monomers 24%
• wave functions 20%
• energy 15%
• oligomers 15%
• charge distribution 13%
• functionals 12%
• chemistry 11%
• density functional theory 10%
• electronic structure 10%
• scaling 9%
• estimates 7%
• simulation 5%

Engineering & Materials Science

• Ammonia 100%
• Water 50%
• Wave functions 37%
• Monomers 31%
• Density functional theory 19%
• Electronic structure 19%
• Charge distribution 19%
• Oligomers 19%