| 35 | 
  | 
 *                                                                       | 
| 36 | 
  | 
 * [1]  Meineke, et al., J. Comp. Chem. 26, 252-271 (2005).              | 
| 37 | 
  | 
 * [2]  Fennell & Gezelter, J. Chem. Phys. 124, 234104 (2006).           | 
| 38 | 
< | 
 * [3]  Sun, Lin & Gezelter, J. Chem. Phys. 128, 24107 (2008).           | 
| 38 | 
> | 
 * [3]  Sun, Lin & Gezelter, J. Chem. Phys. 128, 234107 (2008).           | 
| 39 | 
  | 
 * [4]  Kuang & Gezelter,  J. Chem. Phys. 133, 164101 (2010). | 
| 40 | 
  | 
 * [5]  Vardeman, Stocker & Gezelter, J. Chem. Theory Comput. 7, 834 (2011). | 
| 41 | 
  | 
 */ | 
| 73 | 
  | 
     */ | 
| 74 | 
  | 
    const RealType viscoConvert = 1.439326479e4;  | 
| 75 | 
  | 
 | 
| 76 | 
+ | 
    /* | 
| 77 | 
+ | 
     *  densityConvert | 
| 78 | 
+ | 
     *    used for converting amu / Angstroms^3 into  g / cm^3 | 
| 79 | 
+ | 
     */ | 
| 80 | 
+ | 
    const RealType densityConvert = 1.66053886; | 
| 81 | 
+ | 
 | 
| 82 | 
  | 
    /*  | 
| 83 | 
  | 
     *  thermalConductivityConvert    | 
| 84 | 
  | 
     *    multiplies standard input file units of  |