towhee_ff Version
          14
Number of Nonbonded Types
           9
Potential Type
Lennard-Jones                 
Classical Mixrule
LB or Geometric               
Atom Type Number
           1
Nonbond Coefficients
    0.3816610207E+01
    0.2369969391E+02
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1373300000E+03
Element
Ba
Bond Pattern
ion  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
Aqvist    
Atom Names
Ba+2      
Ba+2      
Ba+2      
Ba+2      
Atom Type Number
           2
Nonbond Coefficients
    0.2412031298E+01
    0.2262749999E+03
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.4008000000E+02
Element
Ca
Bond Pattern
ion  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
Aqvist    
Atom Names
Ca+2      
Ca+2      
Ca+2      
Ca+2      
Atom Type Number
           3
Nonbond Coefficients
    0.6715999823E+01
    0.4057221434E-01
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1329000000E+03
Element
Cs
Bond Pattern
ion  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
Aqvist    
Atom Names
Cs+       
Cs+       
Cs+       
Cs+       
Atom Type Number
           4
Nonbond Coefficients
    0.4934628186E+01
    0.1648719868E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.3909800000E+02
Element
 K
Bond Pattern
ion  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
Aqvist    
Atom Names
K+        
K+        
K+        
K+        
Atom Type Number
           5
Nonbond Coefficients
    0.2126451899E+01
    0.9198315119E+01
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.6941000000E+01
Element
Li
Bond Pattern
ion  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
Aqvist    
Atom Names
Li+       
Li+       
Li+       
Li+       
Atom Type Number
           6
Nonbond Coefficients
    0.1644470697E+01
    0.4403366014E+03
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.2430500000E+02
Element
Mg
Bond Pattern
ion  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
Aqvist    
Atom Names
Mg+2      
Mg+2      
Mg+2      
Mg+2      
Atom Type Number
           7
Nonbond Coefficients
    0.3330446062E+01
    0.1395017782E+01
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.2299000000E+02
Element
Na
Bond Pattern
ion  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
Aqvist    
Atom Names
Na+       
Na+       
Na+       
Na+       
Atom Type Number
           8
Nonbond Coefficients
    0.5621773662E+01
    0.8580069183E-01
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.8547000000E+02
Element
Rb
Bond Pattern
ion  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
Aqvist    
Atom Names
Rb+       
Rb+       
Rb+       
Rb+       
Atom Type Number
           9
Nonbond Coefficients
    0.3102687652E+01
    0.5949322377E+02
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.8762000000E+02
Element
Sr
Bond Pattern
ion  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
Aqvist    
Atom Names
Sr+2      
Sr+2      
Sr+2      
Sr+2      
Number of Bonded Terms
           0
Number of Angle Terms
           0
Number of Torsion Terms
           0
Number of Improper Terms
           0
Number of Angle-Angle Terms
           0
Number of One-Five Types
           0
Number of Bond Increments
           0
