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Searched refs:lambda_vdw (Results 1 – 11 of 11) sorted by last modified time

/dports/science/code_saturne/code_saturne-7.1.0/src/lagr/
H A Dcs_lagr_clogging.c124 const cs_real_t *lambda_vdw in cloginit() argument
146 cs_lagr_clogging_param.lambda_vdw = *lambda_vdw; in cloginit()
299 cs_lagr_clogging_param.lambda_vdw, in cs_lagr_clogging_barrier()
340 cs_lagr_clogging_param.lambda_vdw, in cs_lagr_clogging_barrier()
H A Dcs_lagr_clogging.h60 cs_real_t lambda_vdw; member
87 const cs_real_t *lambda_vdw
H A Dcs_lagr_dlvo.c127 const cs_real_t lambda_vdw) in cs_lagr_dlvo_init() argument
143 cs_lagr_dlvo_param.lambda_vdw = lambda_vdw; in cs_lagr_dlvo_init()
228 cs_lagr_dlvo_param.lambda_vdw, in cs_lagr_barrier()
313 cs_real_t lambda_vdw, in cs_lagr_van_der_waals_sphere_plane() argument
318 if (distp < (lambda_vdw / 2 / _pi)) { in cs_lagr_van_der_waals_sphere_plane()
320 * (1 / (1 + 14 * distp / lambda_vdw + 5 * _pi/4.9 in cs_lagr_van_der_waals_sphere_plane()
321 * pow(distp,3) / lambda_vdw / pow(rpart,2))); in cs_lagr_van_der_waals_sphere_plane()
325 * ((2.45 * lambda_vdw ) /(60. * _pi) in cs_lagr_van_der_waals_sphere_plane()
330 + 0.59 / 5040. / pow(_pi,3) * pow(lambda_vdw,3) in cs_lagr_van_der_waals_sphere_plane()
347 cs_real_t lambda_vdw, in cs_lagr_van_der_waals_sphere_sphere() argument
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H A Dcs_lagr_dlvo.h57 cs_real_t lambda_vdw; member
78 const cs_real_t lambda_vdw);
115 cs_real_t lambda_vdw,
127 cs_real_t lambda_vdw,
H A Dcs_lagr_roughness.h53 cs_real_t lambda_vdw; member
81 const cs_real_t *lambda_vdw,
H A Dcs_lagr.c1979 cs_glob_lagr_physico_chemical->lambda_vdw); in cs_lagr_solve_time_step()
1992 &cs_glob_lagr_physico_chemical->lambda_vdw, in cs_lagr_solve_time_step()
2013 &cs_glob_lagr_physico_chemical->lambda_vdw); in cs_lagr_solve_time_step()
H A Dcs_lagr_adh.c113 cs_real_t lambda_vdw, in _vdwsp() argument
118 if (*distp < lambda_vdw / 2.0 / cs_math_pi) in _vdwsp()
121 / lambda_vdw / pow (*rpart, 2.0))); in _vdwsp()
123 *var = cstham * (2.45 / 60.0 / cs_math_pi * lambda_vdw in _vdwsp()
126 - 2.17 / 720.0 / pow (cs_math_pi, 2) * pow (lambda_vdw, 2.0) in _vdwsp()
128 + 0.59 / 5040.0 / pow (cs_math_pi, 3.0) * pow (lambda_vdw, 3.0) in _vdwsp()
139 cs_real_t lambda_vdw, in _vdwss() argument
149 - 5.32 * (*distcc - *rpart1 - *rpart2) / lambda_vdw in _vdwss()
150 * log (1.0 + lambda_vdw / (*distcc - *rpart1 - *rpart2) / 5.32)); in _vdwss()
532 _vdwsp(lag_pc->cstham, lag_pc->lambda_vdw, &distp, &rpart, &uvdwsp); in cs_lagr_adh()
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H A Dcs_lagr_roughness.c92 .lambda_vdw = 0,
132 const cs_real_t *lambda_vdw, in roughness_init() argument
151 cs_lagr_roughness_param->cstham = *lambda_vdw; in roughness_init()
390 cs_lagr_roughness_param->lambda_vdw); in cs_lagr_roughness_barrier()
415 cs_lagr_roughness_param->lambda_vdw); in cs_lagr_roughness_barrier()
H A Dcs_lagr.h792 cs_real_t lambda_vdw; member
/dports/science/code_saturne/code_saturne-7.1.0/src/user_examples/
H A Dcs_user_lagr_model.c471 cs_glob_lagr_physico_chemical->lambda_vdw = 1000.0; in cs_user_lagr_model()
/dports/science/gromacs/gromacs-2021.4/src/gromacs/gmxlib/nonbonded/
H A Dnb_free_energy.cpp247 const real lambda_vdw = kernel_data->lambda[efptVDW]; in nb_free_energy_kernel() local
352 LFV[STATE_A] = one - lambda_vdw; in nb_free_energy_kernel()
356 LFV[STATE_B] = lambda_vdw; in nb_free_energy_kernel()