| 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). |
| 39 |
< |
* [4] Vardeman & Gezelter, in progress (2009). |
| 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 |
|
*/ |
| 42 |
|
|
| 43 |
|
/** |
| 44 |
|
* @file NumericConstant.hpp |
| 45 |
|
* @author teng lin |
| 46 |
|
* @date 11/17/2004 |
| 46 |
– |
* @time 23:33am |
| 47 |
|
* @version 1.0 |
| 48 |
|
*/ |
| 49 |
|
|
| 50 |
|
#ifndef UTILS_NUMERICCONSTANT_HPP |
| 51 |
|
#define UTILS_NUMERICCONSTANT_HPP |
| 52 |
+ |
#include "config.h" |
| 53 |
|
#include <cmath> |
| 54 |
|
#include <limits> |
| 55 |
+ |
|
| 56 |
|
namespace OpenMD { |
| 57 |
|
|
| 58 |
|
/** |
| 64 |
|
static const RealType epsilon = std::numeric_limits<RealType>::epsilon(); |
| 65 |
|
static const RealType PI = M_PI; |
| 66 |
|
static const RealType TWO_PI = 2.0 * PI; |
| 67 |
+ |
static const RealType infinity = std::numeric_limits<RealType>::infinity(); |
| 68 |
|
} |
| 69 |
|
|
| 70 |
|
|
