/dports/science/lammps/lammps-stable_29Sep2021/lib/gpu/ |
H A D | lal_coul_dsf.cpp | 59 _cut_coulsq=host_cut_coulsq; in init() 128 &_cut_coulsq, &_qqrd2e, &_e_shift, &_f_shift, &_alpha, in loop() 136 &_cut_coulsq, &_qqrd2e, &_e_shift, &_f_shift, &_alpha, in loop()
|
H A D | lal_coul_long.cpp | 83 _cut_coulsq=host_cut_coulsq; in init() 134 &this->atom->q, &_cut_coulsq, &_qqrd2e, &_g_ewald, in loop() 141 &ainum, &nbor_pitch, &this->atom->q, &_cut_coulsq, in loop()
|
H A D | lal_lj_class2_long.cpp | 96 _cut_coulsq=host_cut_coulsq; in init() 141 &_cut_coulsq, &_qqrd2e, &_g_ewald, in loop() 149 &nbor_pitch, &this->atom->q, &_cut_coulsq, in loop()
|
H A D | lal_lj_sdk_long.cpp | 97 _cut_coulsq=host_cut_coulsq; in init() 142 &_cut_coulsq, &_qqrd2e, &_g_ewald, in loop() 149 &ainum, &nbor_pitch, &this->atom->q, &_cut_coulsq, in loop()
|
H A D | lal_lj_dsf.cpp | 63 _cut_coulsq=host_cut_coulsq; in init() 143 &_cut_coulsq, &_qqrd2e, &_e_shift, &_f_shift, &_alpha, in loop() 151 &_cut_coulsq, &_qqrd2e, &_e_shift, &_f_shift, &_alpha, in loop()
|
H A D | lal_born_coul_long.cpp | 100 _cut_coulsq=host_cut_coulsq; in init() 149 &cutsq_sigma, &_cut_coulsq, &_qqrd2e, in loop() 158 &cutsq_sigma, &_cut_coulsq, in loop()
|
H A D | lal_dipole_long_lj.cpp | 99 _cut_coulsq=host_cut_coulsq; in init() 147 &this->atom->quat, &cutsq, &_cut_coulsq, in loop() 156 &this->atom->quat, &cutsq, &_cut_coulsq, in loop()
|
H A D | lal_buck_coul_long.cpp | 98 _cut_coulsq=host_cut_coulsq; in init() 144 &cutsq, &_cut_coulsq, &_qqrd2e, in loop() 152 &_cut_coulsq, &_qqrd2e, &_g_ewald, &this->_threads_per_atom); in loop()
|
H A D | lal_charmm_long.cpp | 101 _cut_coulsq = host_cut_coulsq; in init() 149 &_cut_coulsq, &_qqrd2e, &_g_ewald, &_denom_lj, in loop() 158 &_cut_coulsq, &_qqrd2e, &_g_ewald, &_denom_lj, in loop()
|
H A D | lal_born_coul_wolf.cpp | 100 _cut_coulsq=host_cut_coulsq; in init() 149 &cutsq_sigma, &_cut_coulsq, &_qqrd2e, in loop() 158 &cutsq_sigma, &_cut_coulsq, in loop()
|
H A D | lal_charmm.cpp | 99 _cut_coulsq = host_cut_coulsq; in init() 148 &_cut_coulsq, &_qqrd2e, &_denom_lj, &_denom_coul, in loop() 157 &_cut_coulsq, &_qqrd2e, &_denom_lj, &_denom_coul, in loop()
|
H A D | lal_lj_coul_long.cpp | 96 _cut_coulsq=host_cut_coulsq; in init() 158 &_cut_coulsq, &_qqrd2e, &_g_ewald, in loop() 166 &nbor_pitch, &this->atom->q, &_cut_coulsq, in loop()
|
H A D | lal_lj_expand_coul_long.cpp | 96 _cut_coulsq=host_cut_coulsq; in init() 158 &_cut_coulsq, &_qqrd2e, &_g_ewald, in loop() 166 &nbor_pitch, &this->atom->q, &_cut_coulsq, in loop()
|
H A D | lal_lj_coul_msm.cpp | 127 _cut_coulsq=host_cut_coulsq; in init() 175 &_cut_coulsq, &_qqrd2e, &_order, in loop() 183 &nbor_pitch, &this->atom->q, &_cut_coulsq, in loop()
|
/dports/science/liggghts/LIGGGHTS-PUBLIC-3.8.0-26-g6e873439/lib/gpu/ |
H A D | lal_coul_dsf.cpp | 59 _cut_coulsq=host_cut_coulsq; in init() 139 &_cut_coulsq, &_qqrd2e, &_e_shift, &_f_shift, &_alpha, in loop() 147 &_cut_coulsq, &_qqrd2e, &_e_shift, &_f_shift, &_alpha, in loop()
|
H A D | lal_coul_long.cpp | 85 _cut_coulsq=host_cut_coulsq; in init() 141 &this->atom->q, &_cut_coulsq, &_qqrd2e, &_g_ewald, in loop() 148 &ainum, &nbor_pitch, &this->atom->q, &_cut_coulsq, in loop()
|
H A D | lal_lj_coul_long.cpp | 96 _cut_coulsq=host_cut_coulsq; in init() 152 &_cut_coulsq, &_qqrd2e, &_g_ewald, in loop() 160 &nbor_pitch, &this->atom->q, &_cut_coulsq, in loop()
|
H A D | lal_lj_class2_long.cpp | 96 _cut_coulsq=host_cut_coulsq; in init() 152 &_cut_coulsq, &_qqrd2e, &_g_ewald, in loop() 160 &nbor_pitch, &this->atom->q, &_cut_coulsq, in loop()
|
H A D | lal_born_coul_long.cpp | 100 _cut_coulsq=host_cut_coulsq; in init() 160 &cutsq_sigma, &_cut_coulsq, &_qqrd2e, in loop() 169 &cutsq_sigma, &_cut_coulsq, in loop()
|
H A D | lal_buck_coul_long.cpp | 98 _cut_coulsq=host_cut_coulsq; in init() 154 &cutsq, &_cut_coulsq, &_qqrd2e, in loop() 162 &_cut_coulsq, &_qqrd2e, &_g_ewald, &this->_threads_per_atom); in loop()
|
H A D | lal_cg_cmm_long.cpp | 97 _cut_coulsq=host_cut_coulsq; in init() 153 &_cut_coulsq, &_qqrd2e, &_g_ewald, in loop() 160 &ainum, &nbor_pitch, &this->atom->q, &_cut_coulsq, in loop()
|
H A D | lal_lj_dsf.cpp | 63 _cut_coulsq=host_cut_coulsq; in init() 154 &_cut_coulsq, &_qqrd2e, &_e_shift, &_f_shift, &_alpha, in loop() 162 &_cut_coulsq, &_qqrd2e, &_e_shift, &_f_shift, &_alpha, in loop()
|
H A D | lal_charmm_long.cpp | 98 _cut_coulsq = host_cut_coulsq; in init() 157 &_cut_coulsq, &_qqrd2e, &_g_ewald, &_denom_lj, in loop() 166 &_cut_coulsq, &_qqrd2e, &_g_ewald, &_denom_lj, in loop()
|
H A D | lal_born_coul_wolf.cpp | 100 _cut_coulsq=host_cut_coulsq; in init() 160 &cutsq_sigma, &_cut_coulsq, &_qqrd2e, in loop() 169 &cutsq_sigma, &_cut_coulsq, in loop()
|
H A D | lal_lj_coul_msm.cpp | 127 _cut_coulsq=host_cut_coulsq; in init() 186 &_cut_coulsq, &_qqrd2e, &_order, in loop() 194 &nbor_pitch, &this->atom->q, &_cut_coulsq, in loop()
|