/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | manybody_quip.F | 138 energy=pot_quip, force=force, virial=virial, & 149 energy=pot_quip, force=force, virial=virial, output_unit=output_unit) 153 force = force/(evolt/angstrom) 157 IF (PRESENT(para_env)) force = force/REAL(para_env%num_pe, dp) 166 IF (ASSOCIATED(quip_data%force)) THEN 171 IF (.NOT. ASSOCIATED(quip_data%force)) THEN 172 ALLOCATE (quip_data%force(3, n_atoms_use)) 183 quip_data%force = force 186 DEALLOCATE (use_atom, pos, force, elem_symbol) 210 MARK_USED(force) [all …]
|
/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | manybody_quip.F | 138 energy=pot_quip, force=force, virial=virial, & 149 energy=pot_quip, force=force, virial=virial, output_unit=output_unit) 153 force = force/(evolt/angstrom) 157 IF (PRESENT(para_env)) force = force/REAL(para_env%num_pe, dp) 166 IF (ASSOCIATED(quip_data%force)) THEN 171 IF (.NOT. ASSOCIATED(quip_data%force)) THEN 172 ALLOCATE (quip_data%force(3, n_atoms_use)) 183 quip_data%force = force 186 DEALLOCATE (use_atom, pos, force, elem_symbol) 210 MARK_USED(force) [all …]
|
/dports/textproc/uncrustify/uncrustify-uncrustify-0.74.0/tests/config/cs/ |
H A D | U01-Cs.cfg | 59 sp_paren_brace=force 71 sp_sparen_brace=force 72 sp_special_semi=force 140 sp_after_new=force 172 nl_enum_brace=force 175 nl_if_brace=force 176 nl_brace_else=force 177 nl_else_brace=force 181 nl_try_brace=force 183 nl_for_brace=force [all …]
|
/dports/science/lammps/lammps-stable_29Sep2021/src/ |
H A D | compute_pe_atom.cpp | 115 if (force->kspace && force->kspace->tip4pflag) nkspace += atom->nghost; in compute_peratom() 123 if (pairflag && force->pair && force->pair->compute_flag) { in compute_peratom() 124 double *eatom = force->pair->eatom; in compute_peratom() 128 if (bondflag && force->bond) { in compute_peratom() 129 double *eatom = force->bond->eatom; in compute_peratom() 133 if (angleflag && force->angle) { in compute_peratom() 134 double *eatom = force->angle->eatom; in compute_peratom() 138 if (dihedralflag && force->dihedral) { in compute_peratom() 143 if (improperflag && force->improper) { in compute_peratom() 148 if (kspaceflag && force->kspace && force->kspace->compute_flag) { in compute_peratom() [all …]
|
H A D | compute_pe.cpp | 91 if (pairflag && force->pair) one += force->pair->eng_vdwl + force->pair->eng_coul; in compute_scalar() 94 if (bondflag && force->bond) one += force->bond->energy; in compute_scalar() 95 if (angleflag && force->angle) one += force->angle->energy; in compute_scalar() 96 if (dihedralflag && force->dihedral) one += force->dihedral->energy; in compute_scalar() 97 if (improperflag && force->improper) one += force->improper->energy; in compute_scalar() 102 if (kspaceflag && force->kspace) scalar += force->kspace->energy; in compute_scalar() 104 if (pairflag && force->pair && force->pair->tail_flag) { in compute_scalar() 106 scalar += force->pair->etail / volume; in compute_scalar()
|
H A D | write_coeff.cpp | 59 if (force->pair && force->pair->writedata) { in command() 61 force->pair->write_data_all(one); in command() 64 if (force->bond && force->bond->writedata) { in command() 66 force->bond->write_data(one); in command() 69 if (force->angle && force->angle->writedata) { in command() 71 force->angle->write_data(one); in command() 74 if (force->dihedral && force->dihedral->writedata) { in command() 76 force->dihedral_style); in command() 77 force->dihedral->write_data(one); in command() 80 if (force->improper && force->improper->writedata) { in command() [all …]
|
/dports/science/quantum-espresso/q-e-qe-6.7.0/PW/examples/example03/reference/ |
H A D | si.md8.out | 231 Total force = 0.073907 Total SCF correction = 0.000064 325 Total force = 0.073459 Total SCF correction = 0.000030 417 Total force = 0.072126 Total SCF correction = 0.000049 509 Total force = 0.069930 Total SCF correction = 0.000029 601 Total force = 0.066899 Total SCF correction = 0.000033 693 Total force = 0.063079 Total SCF correction = 0.000017 785 Total force = 0.058525 Total SCF correction = 0.000017 857 Total force = 0.053305 Total SCF correction = 0.000111 949 Total force = 0.047490 Total SCF correction = 0.000044 1041 Total force = 0.041159 Total SCF correction = 0.000026 [all …]
|
/dports/games/searchandrescue/searchandrescue_1.4.0/sar/ |
H A D | stategl.c | 94 if(!s->blend || force) in StateGLEnableF() 126 if(!s->dither || force) in StateGLEnableF() 134 if(!s->fog || force) in StateGLEnableF() 150 if(!s->light0 || force) in StateGLEnableF() 158 if(!s->light1 || force) in StateGLEnableF() 166 if(!s->light2 || force) in StateGLEnableF() 174 if(!s->light3 || force) in StateGLEnableF() 182 if(!s->light4 || force) in StateGLEnableF() 190 if(!s->light5 || force) in StateGLEnableF() 335 if(s->blend || force) in StateGLDisableF() [all …]
|
/dports/devel/fuzzylite/fuzzylite-6.0/examples/mamdani/matlab/ |
H A D | mam21.cpp | 32 OutputVariable* force = new OutputVariable; in main() local 33 force->setName("force"); in main() 34 force->setDescription(""); in main() 35 force->setEnabled(true); in main() 36 force->setRange(-5.000, 5.000); in main() 37 force->setLockValueInRange(false); in main() 38 force->setAggregation(new Maximum); in main() 39 force->setDefuzzifier(new Centroid(200)); in main() 40 force->setDefaultValue(fl::nan); in main() 41 force->setLockPreviousValue(false); in main() [all …]
|
/dports/science/rdkit/rdkit-Release_2021_03_5/Code/GraphMol/Descriptors/ |
H A D | PMI.cpp | 23 double& pm2, double& pm3, bool force) { in getMoments() argument 50 conf, axes, moments, ignoreHs, force, &weights); in getMoments() 93 conf, axes, moments, ignoreHs, force, &weights); in getMomentsFromGyration() 96 conf, axes, moments, ignoreHs, force); in getMomentsFromGyration() 164 bool force) { in radiusOfGyration() argument 168 force)) { in radiusOfGyration() 176 bool force) { in inertialShapeFactor() argument 191 bool force) { in eccentricity() argument 207 bool force) { in asphericity() argument 211 force)) { in asphericity() [all …]
|
/dports/games/allacrost/allacrost-1.0.2/src/engine/video/ |
H A D | shake.cpp | 30 if (force < 0.0f) { in ShakeScreen() 52 shake.initial_force = force; in ShakeScreen() 58 shake.interpolator.Start(force, 0.0f, falloff_time); in ShakeScreen() 63 shake.interpolator.Start(0.0f, force, falloff_time); in ShakeScreen() 68 shake.interpolator.Start(force, 0.0f, falloff_time); in ShakeScreen() 73 shake.interpolator.Start(force, 0.0f, falloff_time); in ShakeScreen() 137 float VideoEngine::_RoundForce(float force) { in _RoundForce() argument 138 int32 fraction_percent = static_cast<int32>(force * 100.0f) - (static_cast<int32>(force) * 100); in _RoundForce() 142 force = ceilf(force); in _RoundForce() 144 force = floorf(force); in _RoundForce() [all …]
|
/dports/science/liggghts/LIGGGHTS-PUBLIC-3.8.0-26-g6e873439/src/ |
H A D | compute_pe_atom.cpp | 141 if (force->kspace && force->kspace->tip4pflag) nkspace += atom->nghost; in compute_peratom() 149 if (pairflag && force->pair) { in compute_peratom() 150 double *eatom = force->pair->eatom; in compute_peratom() 154 if (bondflag && force->bond) { in compute_peratom() 155 double *eatom = force->bond->eatom; in compute_peratom() 159 if (angleflag && force->angle) { in compute_peratom() 160 double *eatom = force->angle->eatom; in compute_peratom() 164 if (dihedralflag && force->dihedral) { in compute_peratom() 169 if (improperflag && force->improper) { in compute_peratom() 174 if (kspaceflag && force->kspace) { in compute_peratom() [all …]
|
/dports/multimedia/cheese/cheese-41.1/tools/ |
H A D | cheese-indent.cfg | 171 sp_arith = force # ignore/add/remove/force 174 sp_assign = force # ignore/add/remove/force 183 sp_enum_assign = force # ignore/add/remove/force 198 sp_bool = force # ignore/add/remove/force 201 sp_compare = force # ignore/add/remove/force 216 sp_before_ptr_star = force # ignore/add/remove/force 235 sp_before_byref = force # ignore/add/remove/force 251 sp_after_type = force # ignore/add/remove/force 273 sp_before_sparen = force # ignore/add/remove/force 282 sp_after_sparen = force # ignore/add/remove/force [all …]
|
/dports/lang/sagittarius-scheme/sagittarius-0.9.8/test/tests/srfi/ |
H A D | %3a45.scm | 24 (force s) 25 (force s) 33 (+ (force s) (force s))) 45 (force t) 46 (force r) 66 (car (force (stream-drop s 4))) 80 (force p))))) 95 (force f)) 108 (force p) 173 (lazy (match (force s) [all …]
|
/dports/textproc/uncrustify/uncrustify-uncrustify-0.74.0/tests/config/cpp/ |
H A D | Issue_3220-f.cfg | 2 sp_after_ptr_star = force 3 sp_after_ptr_star_func = force 4 sp_after_ptr_star_trailing = force 5 sp_after_ptr_star_qualifier = force 6 sp_before_ptr_star = force 7 sp_before_ptr_star_func = force 8 sp_before_ptr_star_trailing = force 9 sp_before_unnamed_ptr_star = force 10 sp_between_ptr_star = force 11 sp_ptr_star_paren = force
|
H A D | templates-i.cfg | 3 sp_arith = force 6 sp_after_byref = force 8 sp_before_angle = force 9 sp_inside_angle = force 10 sp_inside_angle_empty = force 11 sp_after_angle = force 13 sp_angle_paren_empty = force 14 sp_after_operator = force 15 sp_inside_braces_struct = force 16 sp_inside_braces = force [all …]
|
H A D | templates-r.cfg | 3 sp_arith = force 6 sp_after_byref = force 8 sp_before_angle = force 9 sp_inside_angle = force 10 sp_inside_angle_empty = force 11 sp_after_angle = force 13 sp_angle_paren_empty = force 14 sp_after_operator = force 15 sp_inside_braces_struct = force 16 sp_inside_braces = force [all …]
|
/dports/textproc/uncrustify/uncrustify-uncrustify-0.74.0/etc/ |
H A D | sun.cfg | 289 sp_arith = force # ignore/add/remove/force 292 sp_assign = force # ignore/add/remove/force 295 sp_cpp_lambda_assign = force # ignore/add/remove/force 298 sp_assign_default = force # ignore/add/remove/force 301 sp_before_assign = force # ignore/add/remove/force 304 sp_after_assign = force # ignore/add/remove/force 307 sp_enum_paren = force # ignore/add/remove/force 310 sp_enum_assign = force # ignore/add/remove/force 313 sp_enum_before_assign = force # ignore/add/remove/force 316 sp_enum_after_assign = force # ignore/add/remove/force [all …]
|
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/grid/ |
H A D | grid_fast.F | 74 REAL(dp), INTENT(INOUT) :: force(3) local 99 force(1) = force(1) + fx1*zdat(1, iz)*ydat(1, iy) 100 force(2) = force(2) + fyz1*zdat(1, iz)*ydat(2, iy) 101 force(3) = force(3) + fyz1*zdat(2, iz)*ydat(1, iy) 102 force(1) = force(1) + fx2*zdat(1, iz)*ydat(1, iy2) 103 force(2) = force(2) + fyz2*zdat(1, iz)*ydat(2, iy2) 104 force(3) = force(3) + fyz2*zdat(2, iz)*ydat(1, iy2) 119 force(1) = force(1) + fx2*zdat(1, iz)*ydat(1, iy2) 120 force(2) = force(2) + fyz2*zdat(1, iz)*ydat(2, iy2) 121 force(3) = force(3) + fyz2*zdat(2, iz)*ydat(1, iy2)
|
/dports/science/cp2k-data/cp2k-7.1.0/src/grid/ |
H A D | grid_fast.F | 74 REAL(dp), INTENT(INOUT) :: force(3) local 99 force(1) = force(1) + fx1*zdat(1, iz)*ydat(1, iy) 100 force(2) = force(2) + fyz1*zdat(1, iz)*ydat(2, iy) 101 force(3) = force(3) + fyz1*zdat(2, iz)*ydat(1, iy) 102 force(1) = force(1) + fx2*zdat(1, iz)*ydat(1, iy2) 103 force(2) = force(2) + fyz2*zdat(1, iz)*ydat(2, iy2) 104 force(3) = force(3) + fyz2*zdat(2, iz)*ydat(1, iy2) 119 force(1) = force(1) + fx2*zdat(1, iz)*ydat(1, iy2) 120 force(2) = force(2) + fyz2*zdat(1, iz)*ydat(2, iy2) 121 force(3) = force(3) + fyz2*zdat(2, iz)*ydat(1, iy2)
|
/dports/science/lammps/lammps-stable_29Sep2021/lib/gpu/ |
H A D | lal_table.cu | 114 f.x+=delx*force; in k_table() 115 f.y+=dely*force; in k_table() 116 f.z+=delz*force; in k_table() 216 f.x+=delx*force; in k_table_fast() 217 f.y+=dely*force; in k_table_fast() 218 f.z+=delz*force; in k_table_fast() 320 f.x+=delx*force; in k_table_linear() 321 f.y+=dely*force; in k_table_linear() 322 f.z+=delz*force; in k_table_linear() 426 f.x+=delx*force; in k_table_linear_fast() [all …]
|
/dports/science/liggghts/LIGGGHTS-PUBLIC-3.8.0-26-g6e873439/lib/gpu/ |
H A D | lal_table.cu | 111 f.x+=delx*force; in k_table() 112 f.y+=dely*force; in k_table() 113 f.z+=delz*force; in k_table() 210 f.x+=delx*force; in k_table_fast() 211 f.y+=dely*force; in k_table_fast() 212 f.z+=delz*force; in k_table_fast() 311 f.x+=delx*force; in k_table_linear() 312 f.y+=dely*force; in k_table_linear() 313 f.z+=delz*force; in k_table_linear() 414 f.x+=delx*force; in k_table_linear_fast() [all …]
|
/dports/devel/stxxl/stxxl-1.4.1/misc/ |
H A D | uncrustify.cfg | 232 sp_arith = force # ignore/add/remove/force 235 sp_assign = force # ignore/add/remove/force 244 sp_assign_default = force # ignore/add/remove/force 247 sp_before_assign = force # ignore/add/remove/force 250 sp_after_assign = force # ignore/add/remove/force 253 sp_enum_assign = force # ignore/add/remove/force 256 sp_enum_before_assign = force # ignore/add/remove/force 259 sp_enum_after_assign = force # ignore/add/remove/force 262 sp_pp_concat = force # ignore/add/remove/force 271 sp_bool = force # ignore/add/remove/force [all …]
|
/dports/net/megacmd/MEGAcmd-1.4.1_Win/sdk/contrib/ |
H A D | uncrustify.cfg | 121 sp_arith=force 122 sp_assign=force 125 sp_after_assign=force 126 sp_enum_assign=force 129 sp_bool=force 130 sp_compare=force 131 sp_inside_paren=force 133 sp_paren_brace=force 136 sp_sparen_brace=force 140 sp_after_comma=force [all …]
|
/dports/x11/swayfloatingswitcher/SwayFloatingSwitcher-4f02259/ |
H A D | .uncrustify.cfg | 258 sp_arith = force # ignore/add/remove/force 261 sp_assign = force # ignore/add/remove/force 264 sp_cpp_lambda_assign = force # ignore/add/remove/force 270 sp_assign_default = force # ignore/add/remove/force 273 sp_before_assign = force # ignore/add/remove/force 276 sp_after_assign = force # ignore/add/remove/force 279 sp_enum_assign = force # ignore/add/remove/force 285 sp_enum_after_assign = force # ignore/add/remove/force 297 sp_bool = force # ignore/add/remove/force 300 sp_compare = force # ignore/add/remove/force [all …]
|