| 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 |
|
*/ |
| 88 |
|
} |
| 89 |
|
|
| 90 |
|
/** |
| 91 |
< |
* Retunrs reference of the first element of Vector3. |
| 91 |
> |
* Returns reference of the first element of Vector3. |
| 92 |
|
* @return reference of the first element of Vector3 |
| 93 |
|
*/ |
| 94 |
|
inline Real& x() { return this->data_[0];} |
| 95 |
|
|
| 96 |
|
/** |
| 97 |
< |
* Retunrs the first element of Vector3. |
| 97 |
> |
* Returns the first element of Vector3. |
| 98 |
|
* @return the first element of Vector3 |
| 99 |
|
*/ |
| 100 |
|
inline Real x() const { return this->data_[0];} |
| 101 |
|
|
| 102 |
|
/** |
| 103 |
< |
* Retunrs reference of the second element of Vector3. |
| 103 |
> |
* Returns reference of the second element of Vector3. |
| 104 |
|
* @return reference of the second element of Vector3 |
| 105 |
|
*/ |
| 106 |
|
inline Real& y() { return this->data_[1];} |
| 107 |
|
|
| 108 |
|
/** |
| 109 |
< |
* Retunrs the second element of Vector3. |
| 109 |
> |
* Returns the second element of Vector3. |
| 110 |
|
* @return c the second element of Vector3 |
| 111 |
|
*/ |
| 112 |
|
inline Real y() const { return this->data_[1];} |
| 113 |
|
|
| 114 |
|
/** |
| 115 |
< |
* Retunrs reference of the third element of Vector3. |
| 115 |
> |
* Returns reference of the third element of Vector3. |
| 116 |
|
* @return reference of the third element of Vector3 |
| 117 |
|
*/ |
| 118 |
|
inline Real& z() { return this->data_[2];} |
| 119 |
|
|
| 120 |
|
/** |
| 121 |
< |
* Retunrs the third element of Vector3. |
| 121 |
> |
* Returns the third element of Vector3. |
| 122 |
|
* @return f the third element of Vector3 |
| 123 |
|
*/ |
| 124 |
|
inline Real z() const { return this->data_[2];} |
| 130 |
|
* @param v1 first vector |
| 131 |
|
* @param v2 second vector |
| 132 |
|
* @return the cross product of v1 and v2 |
| 133 |
– |
* @see #vector::dot |
| 133 |
|
*/ |
| 134 |
|
template<typename Real> |
| 135 |
|
inline Vector3<Real> cross( const Vector3<Real>& v1, const Vector3<Real>& v2 ) { |