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Searched defs:fpair (Results 251 – 275 of 437) sorted by relevance

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/dports/science/lammps/lammps-stable_29Sep2021/src/OPENMP/
H A Dpair_lj_charmm_coul_long_omp.cpp196 const double fpair = (forcecoul + forcelj) * r2inv; in eval() local
H A Dpair_lj_cut_thole_long_omp.cpp118 double ecoul,fpair,evdwl; in eval() local
H A Ddihedral_charmm_omp.cpp102 double forcecoul,forcelj,fpair,ecoul,evdwl; in eval() local
/dports/science/lammps/lammps-stable_29Sep2021/src/GPU/
H A Dpair_lj_sdk_coul_long_gpu.cpp264 double fpair = 0.0; in cpu_compute() local
H A Dpair_born_coul_long_cs_gpu.cpp224 double qtmp,xtmp,ytmp,ztmp,delx,dely,delz,evdwl,ecoul,fpair; in cpu_compute() local
H A Dpair_lj_expand_coul_long_gpu.cpp229 double qtmp,xtmp,ytmp,ztmp,delx,dely,delz,evdwl,ecoul,fpair; in cpu_compute() local
/dports/science/lammps/lammps-stable_29Sep2021/src/CG-SDK/
H A Dpair_lj_sdk_coul_msm.cpp77 double qtmp,xtmp,ytmp,ztmp,delx,dely,delz,evdwl,ecoul,fpair; in eval_msm() local
/dports/science/lammps/lammps-stable_29Sep2021/src/INTERLAYER/
H A Dpair_kolmogorov_crespi_z.cpp83 double xtmp, ytmp, ztmp, delx, dely, delz, evdwl, fpair, fpair1; in compute() local
H A Dpair_lebedeva_z.cpp82 double xtmp,ytmp,ztmp,delx,dely,delz,evdwl,fpair,der; in compute() local
/dports/science/lammps/lammps-stable_29Sep2021/src/ASPHERE/
H A Dpair_line_lj.cpp73 double xtmp,ytmp,ztmp,delx,dely,delz,evdwl,fpair; in compute() local
/dports/science/lammps/lammps-stable_29Sep2021/src/
H A Dpair_soft.cpp56 double xtmp,ytmp,ztmp,delx,dely,delz,evdwl,fpair; in compute() local
H A Dpair_coul_cut.cpp56 double qtmp,xtmp,ytmp,ztmp,delx,dely,delz,ecoul,fpair; in compute() local
H A Dpair_coul_wolf.cpp59 double qtmp,xtmp,ytmp,ztmp,delx,dely,delz,ecoul,fpair; in compute() local
/dports/science/liggghts/LIGGGHTS-PUBLIC-3.8.0-26-g6e873439/src/
H A Dpair_line_lj.cpp103 double xtmp,ytmp,ztmp,delx,dely,delz,evdwl,fpair; in compute() local
/dports/science/liggghts/LIGGGHTS-PUBLIC-3.8.0-26-g6e873439/lib/cuda/
H A Dpair_eam_cuda_kernel_nc.cu183 F_FLOAT fxtmp, fytmp, fztmp, fpair; in PairEAMCuda_Kernel2() local
/dports/science/lammps/lammps-stable_29Sep2021/src/BODY/
H A Dpair_body_rounded_polyhedron.cpp612 double rij,rsqinv,R,fx,fy,fz,fn[3],ft[3],fpair,energy; in sphere_against_sphere() local
694 double delx,dely,delz,rsq,rij,rsqinv,R,fx,fy,fz,fpair,energy; in sphere_against_edge() local
844 double delx,dely,delz,rsq,rij,rsqinv,R,fx,fy,fz,fpair,energy; in sphere_against_face() local
1491 double delx,dely,delz,R,fx,fy,fz,fpair; in pair_force_and_torque() local
1542 double& energy, double& fpair) in kernel_force()
1673 double delx,dely,delz,fx,fy,fz,R,fpair,r,contact_area; in rescale_cohesive_forces() local
/dports/science/lammps/lammps-stable_29Sep2021/src/KOKKOS/
H A Dpair_eam_kokkos.cpp780 const F_FLOAT fpair = -psip*recip; in operator ()() local
822 const F_FLOAT &epair, const F_FLOAT &fpair, const F_FLOAT &delx, in ev_tally()
H A Dpair_multi_lucy_rx_kokkos.cpp278 double xtmp,ytmp,ztmp,delx,dely,delz,evdwl,evdwlOld,fpair; in operator ()() local
774 const F_FLOAT &epair, const F_FLOAT &fpair, const F_FLOAT &delx, in ev_tally()
/dports/science/lammps/lammps-stable_29Sep2021/src/EXTRA-PAIR/
H A Dpair_gauss.cpp66 double xtmp,ytmp,ztmp,delx,dely,delz,evdwl,fpair; in compute() local
H A Dpair_momb.cpp80 double xtmp,ytmp,ztmp,delx,dely,delz,evdwl,fpair; in compute() local
H A Dpair_ufm.cpp64 double xtmp,ytmp,ztmp,delx,dely,delz,evdwl,fpair; in compute() local
H A Dpair_morse_smooth_linear.cpp59 double xtmp,ytmp,ztmp,delx,dely,delz,evdwl,fpair, fpartial; in compute() local
/dports/science/lammps/lammps-stable_29Sep2021/src/DPD-MESO/
H A Dpair_mdpd.cpp84 double xtmp,ytmp,ztmp,delx,dely,delz,evdwl,fpair; in compute() local
/dports/science/lammps/lammps-stable_29Sep2021/src/FEP/
H A Dpair_coul_cut_soft.cpp60 double qtmp,xtmp,ytmp,ztmp,delx,dely,delz,ecoul,fpair; in compute() local
/dports/science/lammps/lammps-stable_29Sep2021/src/CG-DNA/
H A Dmf_oxdna.h119 double eps, double b, double &fpair) in F3()

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