/dports/science/lammps/lammps-stable_29Sep2021/src/OPENMP/ |
H A D | improper_fourier_omp.cpp | 87 double vb1x,vb1y,vb1z,vb2x,vb2y,vb2z,vb3x,vb3y,vb3z; in eval() local 143 const double &vb2z, in add1_thr()
|
H A D | improper_cossq_omp.cpp | 87 double vb1x,vb1y,vb1z,vb2x,vb2y,vb2z,vb3x,vb3y,vb3z; in eval() local
|
H A D | improper_harmonic_omp.cpp | 87 double vb1x,vb1y,vb1z,vb2x,vb2y,vb2z,vb3x,vb3y,vb3z; in eval() local
|
H A D | improper_ring_omp.cpp | 94 double vb1x,vb1y,vb1z,vb2x,vb2y,vb2z,vb3x,vb3y,vb3z; in eval() local
|
H A D | improper_umbrella_omp.cpp | 88 double vb1x,vb1y,vb1z,vb2x,vb2y,vb2z,vb3x,vb3y,vb3z; in eval() local
|
H A D | dihedral_multi_harmonic_omp.cpp | 88 double vb1x,vb1y,vb1z,vb2x,vb2y,vb2z,vb3x,vb3y,vb3z,vb2xm,vb2ym,vb2zm; in eval() local
|
H A D | dihedral_nharmonic_omp.cpp | 87 double vb1x,vb1y,vb1z,vb2x,vb2y,vb2z,vb3x,vb3y,vb3z,vb2xm,vb2ym,vb2zm; in eval() local
|
H A D | improper_cvff_omp.cpp | 87 double vb1x,vb1y,vb1z,vb2x,vb2y,vb2z,vb3x,vb3y,vb3z,vb2xm,vb2ym,vb2zm; in eval() local
|
/dports/science/liggghts/LIGGGHTS-PUBLIC-3.8.0-26-g6e873439/src/ |
H A D | dihedral.cpp | 167 double vb2x, double vb2y, double vb2z, in ev_tally()
|
H A D | improper.cpp | 163 double vb2x, double vb2y, double vb2z, in ev_tally()
|
/dports/science/lammps/lammps-stable_29Sep2021/src/EXTRA-MOLECULE/ |
H A D | improper_fourier.cpp | 59 double vb1x,vb1y,vb1z,vb2x,vb2y,vb2z,vb3x,vb3y,vb3z; in compute() local 112 const double &vb2x, const double &vb2y, const double &vb2z, in addone()
|
H A D | improper_cossq.cpp | 58 double vb1x,vb1y,vb1z,vb2x,vb2y,vb2z,vb3x,vb3y,vb3z ; in compute() local
|
H A D | improper_ring.cpp | 85 double vb1x,vb1y,vb1z,vb2x,vb2y,vb2z,vb3x,vb3y,vb3z; in compute() local
|
/dports/science/lammps/lammps-stable_29Sep2021/src/KOKKOS/ |
H A D | improper_harmonic_kokkos.cpp | 177 const F_FLOAT vb2z = x(i3,2) - x(i2,2); in operator ()() local 363 const F_FLOAT &vb2x, const F_FLOAT &vb2y, const F_FLOAT &vb2z, in ev_tally()
|
H A D | dihedral_harmonic_kokkos.cpp | 181 const F_FLOAT vb2z = x(i3,2) - x(i2,2); in operator ()() local 412 const F_FLOAT &vb2x, const F_FLOAT &vb2y, const F_FLOAT &vb2z, in ev_tally()
|
H A D | dihedral_opls_kokkos.cpp | 180 const F_FLOAT vb2z = x(i3,2) - x(i2,2); in operator ()() local 417 const F_FLOAT &vb2x, const F_FLOAT &vb2y, const F_FLOAT &vb2z, in ev_tally()
|
H A D | dihedral_class2_kokkos.cpp | 220 const F_FLOAT vb2z = x(i3,2) - x(i2,2); in operator ()() local 1013 const F_FLOAT &vb2x, const F_FLOAT &vb2y, const F_FLOAT &vb2z, in ev_tally()
|
H A D | dihedral_charmm_kokkos.cpp | 228 const F_FLOAT vb2z = x(i3,2) - x(i2,2); in operator ()() local 578 const F_FLOAT &vb2x, const F_FLOAT &vb2y, const F_FLOAT &vb2z, in ev_tally()
|
/dports/science/lammps/lammps-stable_29Sep2021/src/MOFFF/ |
H A D | improper_inversion_harmonic.cpp | 64 double vb1x,vb1y,vb1z,vb2x,vb2y,vb2z,vb3x,vb3y,vb3z; in compute() local 129 const double &vb2x, const double &vb2y, const double &vb2z, in invang()
|
/dports/science/lammps/lammps-stable_29Sep2021/src/ |
H A D | improper.cpp | 187 double vb2x, double vb2y, double vb2z, in ev_tally()
|
H A D | dihedral.cpp | 188 double vb2x, double vb2y, double vb2z, in ev_tally()
|
H A D | compute_improper_local.cpp | 113 double vb1x,vb1y,vb1z,vb2x,vb2y,vb2z,vb3x,vb3y,vb3z; in compute_impropers() local
|
H A D | compute_dihedral_local.cpp | 197 double vb1x,vb1y,vb1z,vb2x,vb2y,vb2z,vb3x,vb3y,vb3z,vb2xm,vb2ym,vb2zm; in compute_dihedrals() local
|
/dports/science/lammps/lammps-stable_29Sep2021/src/MOLECULE/ |
H A D | improper_harmonic.cpp | 56 double vb1x,vb1y,vb1z,vb2x,vb2y,vb2z,vb3x,vb3y,vb3z; in compute() local
|
H A D | improper_umbrella.cpp | 62 double vb1x,vb1y,vb1z,vb2x,vb2y,vb2z,vb3x,vb3y,vb3z; in compute() local
|