| 87 |  | return inertiaTensor_; | 
| 88 |  | } | 
| 89 |  |  | 
| 90 | < | std::vector<double> RigidBody::getGrad() { | 
| 91 | < | std::vector<double> grad(6, 0.0); | 
| 90 | > | std::vector<RealType> RigidBody::getGrad() { | 
| 91 | > | std::vector<RealType> grad(6, 0.0); | 
| 92 |  | Vector3d force; | 
| 93 |  | Vector3d torque; | 
| 94 |  | Vector3d myEuler; | 
| 95 | < | double phi, theta, psi; | 
| 96 | < | double cphi, sphi, ctheta, stheta; | 
| 95 | > | RealType phi, theta, psi; | 
| 96 | > | RealType cphi, sphi, ctheta, stheta; | 
| 97 |  | Vector3d ephi; | 
| 98 |  | Vector3d etheta; | 
| 99 |  | Vector3d epsi; | 
| 146 |  |  | 
| 147 |  | /**@todo need modification */ | 
| 148 |  | void  RigidBody::calcRefCoords() { | 
| 149 | < | double mtmp; | 
| 149 | > | RealType mtmp; | 
| 150 |  | Vector3d refCOM(0.0); | 
| 151 |  | mass_ = 0.0; | 
| 152 |  | for (std::size_t i = 0; i < atoms_.size(); ++i) { | 
| 167 |  | Mat3x3d IAtom(0.0); | 
| 168 |  | mtmp = atoms_[i]->getMass(); | 
| 169 |  | IAtom -= outProduct(refCoords_[i], refCoords_[i]) * mtmp; | 
| 170 | < | double r2 = refCoords_[i].lengthSquare(); | 
| 170 | > | RealType r2 = refCoords_[i].lengthSquare(); | 
| 171 |  | IAtom(0, 0) += mtmp * r2; | 
| 172 |  | IAtom(1, 1) += mtmp * r2; | 
| 173 |  | IAtom(2, 2) += mtmp * r2; |