Simulation of liquid water using a high-rank quantum topological electrostatic potential

2004 ◽  
Vol 99 (5) ◽  
pp. 685-694 ◽  
Author(s):  
S. Y. Liem ◽  
P. L. A. Popelier ◽  
M. Leslie
Keyword(s):  
Electrostatic Potential ◽  
Liquid Water ◽  
High Rank

Properties of liquid water from a systematic refinement of a high-rank multipolar electrostatic potential

2010 ◽  
Vol 132 (17) ◽  
pp. 174504 ◽  
Author(s):  
Majeed S. Shaik ◽  
Steven Y. Liem ◽  
Paul L. A. Popelier
Keyword(s):  
Electrostatic Potential ◽  
Liquid Water ◽  
High Rank

scholarly journals Simulation of liquid imidazole using a high-rank quantum topological electrostatic potential

2010 ◽  
Vol 12 (45) ◽  
pp. 15040 ◽  
Author(s):  
Majeed S. Shaik ◽  
Steven Y. Liem ◽  
Yongna Yuan ◽  
Paul L. A. Popelier
Keyword(s):  
Electrostatic Potential ◽  
High Rank
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