Searched refs:atomForces_ (Results 1 – 16 of 16) sorted by relevance
| /dports/science/liggghts/LIGGGHTS-PUBLIC-3.8.0-26-g6e873439/lib/atc/ |
| H A D | GhostManager.cpp | 365 atomForces_(NULL), in GhostModifierDampedHarmonic()
383 atomForces_ = interscaleManager.fundamental_atom_quantity(LammpsInterface::ATOM_FORCE,GHOST); in construct_transfers()
435 *atomForces_ = _forces_; in final_integrate()
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| H A D | ExtrinsicModelElectrostatic.h | 135 FundamentalAtomQuantity * atomForces_; variable
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| H A D | GhostManager.h | 246 PerAtomQuantity<double> * atomForces_; variable
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| H A D | ExtrinsicModelElectrostatic.cpp | 50 atomForces_(NULL), in ExtrinsicModelElectrostatic()
242 atomForces_ = interscaleManager.fundamental_atom_quantity(LammpsInterface::ATOM_FORCE); in initialize()
407 atomForces_ = interscaleManager_.fundamental_atom_quantity(LammpsInterface::ATOM_FORCE); in post_force()
408 (*atomForces_) += _atomElectricalForce_; // f_E in ours, f in lammps ultimately in post_force()
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| H A D | PerAtomQuantityLibrary.cpp | 1369 atomForces_(atomForces), in DotTwiceKineticEnergy()
1373 if (!atomForces_) in DotTwiceKineticEnergy()
1374 atomForces_ = interscaleManager.fundamental_atom_quantity(LammpsInterface::ATOM_FORCE, in DotTwiceKineticEnergy()
1380 atomForces_->register_dependence(this); in DotTwiceKineticEnergy()
1389 atomForces_->remove_dependence(this); in ~DotTwiceKineticEnergy()
1401 const DENS_MAT & force(atomForces_->quantity()); in reset()
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| H A D | ATC_Method.h | 654 FundamentalAtomQuantity * atomForces_; variable
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| H A D | PerAtomQuantityLibrary.h | 927 PerAtomQuantity<double> * atomForces_; variable
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| H A D | ATC_Method.cpp | 67 atomForces_(NULL), in ATC_Method()
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| /dports/science/lammps/lammps-stable_29Sep2021/lib/atc/ |
| H A D | GhostManager.cpp | 387 atomForces_(nullptr), in GhostModifierDampedHarmonic()
405 atomForces_ = interscaleManager.fundamental_atom_quantity(LammpsInterface::ATOM_FORCE,GHOST); in construct_transfers()
466 *atomForces_ = _forces_; in final_integrate()
716 *atomForces_ = _forces_; in final_integrate()
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| H A D | ExtrinsicModelElectrostatic.h | 135 FundamentalAtomQuantity * atomForces_; variable
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| H A D | GhostManager.h | 249 PerAtomQuantity<double> * atomForces_; variable
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| H A D | ExtrinsicModelElectrostatic.cpp | 47 atomForces_(nullptr), in ExtrinsicModelElectrostatic()
239 atomForces_ = interscaleManager.fundamental_atom_quantity(LammpsInterface::ATOM_FORCE); in initialize()
404 atomForces_ = interscaleManager_.fundamental_atom_quantity(LammpsInterface::ATOM_FORCE); in post_force()
405 (*atomForces_) += _atomElectricalForce_; // f_E in ours, f in lammps ultimately in post_force()
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| H A D | PerAtomQuantityLibrary.cpp | 1370 atomForces_(atomForces), in DotTwiceKineticEnergy()
1374 if (!atomForces_) in DotTwiceKineticEnergy()
1375 atomForces_ = interscaleManager.fundamental_atom_quantity(LammpsInterface::ATOM_FORCE, in DotTwiceKineticEnergy()
1381 atomForces_->register_dependence(this); in DotTwiceKineticEnergy()
1390 atomForces_->remove_dependence(this); in ~DotTwiceKineticEnergy()
1402 const DENS_MAT & force(atomForces_->quantity()); in reset()
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| H A D | ATC_Method.h | 661 FundamentalAtomQuantity * atomForces_; variable
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| H A D | PerAtomQuantityLibrary.h | 927 PerAtomQuantity<double> * atomForces_; variable
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| H A D | ATC_Method.cpp | 68 atomForces_(nullptr), in ATC_Method()
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