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Searched refs:dUr (Results 1 – 24 of 24) sorted by relevance

/dports/science/lammps/lammps-stable_29Sep2021/src/ASPHERE/
H A Dpair_gayberne.cpp631 double dUr[3]; in gayberne_analytic() local
649 fforce[0] = temp1*dchi[0]-temp3*dUr[0]; in gayberne_analytic()
650 fforce[1] = temp1*dchi[1]-temp3*dUr[1]; in gayberne_analytic()
651 fforce[2] = temp1*dchi[2]-temp3*dUr[2]; in gayberne_analytic()
660 MathExtra::cross3(tempv,tempv2,dUr); in gayberne_analytic()
720 ttor[0] = (temp1*dchi[0]+temp2*deta[0]+temp3*dUr[0]) * -1.0; in gayberne_analytic()
816 double dUr[3]; in gayberne_lj() local
834 fforce[0] = temp1*dchi[0]-temp2*dUr[0]; in gayberne_lj()
835 fforce[1] = temp1*dchi[1]-temp2*dUr[1]; in gayberne_lj()
836 fforce[2] = temp1*dchi[2]-temp2*dUr[2]; in gayberne_lj()
[all …]
H A Dpair_resquared.cpp745 dUr = pbsr * (eta * dchi + deta * chi) - dh12 * dspr; in resquared_analytic()
746 fforce[m] = dUr * Ur + dUa * Ua; in resquared_analytic()
775 dUr = pbsr * (eta * dchi + deta * chi) - dh12 * dspr; in resquared_analytic()
776 ttor[i] = -(dUa * Ua + dUr * Ur); in resquared_analytic()
807 dUr = pbsr * (eta * dchi + deta * chi) - dh12 * dspr; in resquared_analytic()
808 rtor[i] = -(dUa * Ua + dUr * Ur); in resquared_analytic()
849 double dUr, dUa; // derivatives of Ua,Ur in resquared_lj() local
946 dUr = pbsr * dchi - dh12 * dspr; in resquared_lj()
947 fforce[m] = dUr * Ur + dUa * Ua; in resquared_lj()
964 dUr = pbsr * dchi - dh12 * dspr; in resquared_lj()
[all …]
/dports/science/lammps/lammps-stable_29Sep2021/lib/gpu/
H A Dlal_gayberne.cu161 numtyp u_r, dUr[3], tUr[3], eta, teta[3]; in k_gayberne() local
220 dUr[0] = temp1*r12[0]+uslj_rsq*(kappa[0]-temp2*r12[0]); in k_gayberne()
221 dUr[1] = temp1*r12[1]+uslj_rsq*(kappa[1]-temp2*r12[1]); in k_gayberne()
222 dUr[2] = temp1*r12[2]+uslj_rsq*(kappa[2]-temp2*r12[2]); in k_gayberne()
330 numtyp ft=temp1*dchi[0]-temp2*dUr[0]; in k_gayberne()
333 ft=temp1*dchi[1]-temp2*dUr[1]; in k_gayberne()
337 ft=temp1*dchi[2]-temp2*dUr[2]; in k_gayberne()
343 f.x+=temp1*dchi[0]-temp2*dUr[0]; in k_gayberne()
344 f.y+=temp1*dchi[1]-temp2*dUr[1]; in k_gayberne()
345 f.z+=temp1*dchi[2]-temp2*dUr[2]; in k_gayberne()
H A Dlal_gayberne_lj.cu104 numtyp u_r, dUr[3], eta; in k_gayberne_sphere_ellipsoid() local
166 dUr[0] = temp1*r12hat[0]+uslj_rsq*(kappa[0]-temp2*r12hat[0]); in k_gayberne_sphere_ellipsoid()
167 dUr[1] = temp1*r12hat[1]+uslj_rsq*(kappa[1]-temp2*r12hat[1]); in k_gayberne_sphere_ellipsoid()
168 dUr[2] = temp1*r12hat[2]+uslj_rsq*(kappa[2]-temp2*r12hat[2]); in k_gayberne_sphere_ellipsoid()
232 numtyp ft=temp1*dchi[0]-temp2*dUr[0]; in k_gayberne_sphere_ellipsoid()
235 ft=temp1*dchi[1]-temp2*dUr[1]; in k_gayberne_sphere_ellipsoid()
239 ft=temp1*dchi[2]-temp2*dUr[2]; in k_gayberne_sphere_ellipsoid()
245 f.x+=temp1*dchi[0]-temp2*dUr[0]; in k_gayberne_sphere_ellipsoid()
246 f.y+=temp1*dchi[1]-temp2*dUr[1]; in k_gayberne_sphere_ellipsoid()
247 f.z+=temp1*dchi[2]-temp2*dUr[2]; in k_gayberne_sphere_ellipsoid()
H A Dlal_re_squared.cu312 numtyp dUa, dUr, deta, dchi, ddH, dh12; in k_resquared() local
345 dUr = pbsr*(eta*dchi+deta*chi)-dh12*dspr; in k_resquared()
346 numtyp force=dUr*Ur+dUa*Ua; in k_resquared()
395 dUr = pbsr*(eta*dchi + deta*chi)-dh12*dspr; in k_resquared()
396 tor.x -= (dUa*Ua+dUr*Ur); in k_resquared()
421 dUr = pbsr*(eta*dchi + deta*chi)-dh12*dspr; in k_resquared()
422 tor.y -= (dUa*Ua+dUr*Ur); in k_resquared()
447 dUr = pbsr*(eta*dchi + deta*chi)-dh12*dspr; in k_resquared()
448 tor.z -= (dUa*Ua+dUr*Ur); in k_resquared()
H A Dlal_re_squared_lj.cu332 numtyp dUr = pbsr*dchi-dh12*dspr; in k_resquared_ellipsoid_sphere() local
333 numtyp force=dUr*Ur+dUa*Ua; in k_resquared_ellipsoid_sphere()
367 numtyp dUr = pbsr*dchi-dh12*dspr; in k_resquared_ellipsoid_sphere() local
368 tor.x -= (dUa*Ua+dUr*Ur); in k_resquared_ellipsoid_sphere()
380 numtyp dUr = pbsr*dchi-dh12*dspr; in k_resquared_ellipsoid_sphere() local
381 tor.y -= (dUa*Ua+dUr*Ur); in k_resquared_ellipsoid_sphere()
393 numtyp dUr = pbsr*dchi-dh12*dspr; in k_resquared_ellipsoid_sphere() local
394 tor.z -= (dUa*Ua+dUr*Ur); in k_resquared_ellipsoid_sphere()
579 numtyp dUr = pbsr*dchi-dh12*dspr; in k_resquared_sphere_ellipsoid() local
580 numtyp force=dUr*Ur+dUa*Ua; in k_resquared_sphere_ellipsoid()
/dports/science/liggghts/LIGGGHTS-PUBLIC-3.8.0-26-g6e873439/lib/gpu/
H A Dlal_gayberne.cu163 numtyp u_r, dUr[3], tUr[3], eta, teta[3]; in k_gayberne() local
222 dUr[0] = temp1*r12[0]+uslj_rsq*(kappa[0]-temp2*r12[0]); in k_gayberne()
223 dUr[1] = temp1*r12[1]+uslj_rsq*(kappa[1]-temp2*r12[1]); in k_gayberne()
224 dUr[2] = temp1*r12[2]+uslj_rsq*(kappa[2]-temp2*r12[2]); in k_gayberne()
333 numtyp ft=temp1*dchi[0]-temp2*dUr[0]; in k_gayberne()
336 ft=temp1*dchi[1]-temp2*dUr[1]; in k_gayberne()
340 ft=temp1*dchi[2]-temp2*dUr[2]; in k_gayberne()
346 f.x+=temp1*dchi[0]-temp2*dUr[0]; in k_gayberne()
347 f.y+=temp1*dchi[1]-temp2*dUr[1]; in k_gayberne()
348 f.z+=temp1*dchi[2]-temp2*dUr[2]; in k_gayberne()
H A Dlal_gayberne_lj.cu96 numtyp u_r, dUr[3], eta; in k_gayberne_sphere_ellipsoid() local
158 dUr[0] = temp1*r12hat[0]+uslj_rsq*(kappa[0]-temp2*r12hat[0]); in k_gayberne_sphere_ellipsoid()
159 dUr[1] = temp1*r12hat[1]+uslj_rsq*(kappa[1]-temp2*r12hat[1]); in k_gayberne_sphere_ellipsoid()
160 dUr[2] = temp1*r12hat[2]+uslj_rsq*(kappa[2]-temp2*r12hat[2]); in k_gayberne_sphere_ellipsoid()
224 numtyp ft=temp1*dchi[0]-temp2*dUr[0]; in k_gayberne_sphere_ellipsoid()
227 ft=temp1*dchi[1]-temp2*dUr[1]; in k_gayberne_sphere_ellipsoid()
231 ft=temp1*dchi[2]-temp2*dUr[2]; in k_gayberne_sphere_ellipsoid()
237 f.x+=temp1*dchi[0]-temp2*dUr[0]; in k_gayberne_sphere_ellipsoid()
238 f.y+=temp1*dchi[1]-temp2*dUr[1]; in k_gayberne_sphere_ellipsoid()
239 f.z+=temp1*dchi[2]-temp2*dUr[2]; in k_gayberne_sphere_ellipsoid()
H A Dlal_re_squared.cu315 numtyp dUa, dUr, deta, dchi, ddH, dh12; in k_resquared() local
348 dUr = pbsr*(eta*dchi+deta*chi)-dh12*dspr; in k_resquared()
349 numtyp force=dUr*Ur+dUa*Ua; in k_resquared()
398 dUr = pbsr*(eta*dchi + deta*chi)-dh12*dspr; in k_resquared()
399 tor.x -= (dUa*Ua+dUr*Ur); in k_resquared()
424 dUr = pbsr*(eta*dchi + deta*chi)-dh12*dspr; in k_resquared()
425 tor.y -= (dUa*Ua+dUr*Ur); in k_resquared()
450 dUr = pbsr*(eta*dchi + deta*chi)-dh12*dspr; in k_resquared()
451 tor.z -= (dUa*Ua+dUr*Ur); in k_resquared()
H A Dlal_re_squared_lj.cu315 numtyp dUr = pbsr*dchi-dh12*dspr; in k_resquared_ellipsoid_sphere() local
316 numtyp force=dUr*Ur+dUa*Ua; in k_resquared_ellipsoid_sphere()
350 numtyp dUr = pbsr*dchi-dh12*dspr; in k_resquared_ellipsoid_sphere() local
351 tor.x -= (dUa*Ua+dUr*Ur); in k_resquared_ellipsoid_sphere()
363 numtyp dUr = pbsr*dchi-dh12*dspr; in k_resquared_ellipsoid_sphere() local
364 tor.y -= (dUa*Ua+dUr*Ur); in k_resquared_ellipsoid_sphere()
376 numtyp dUr = pbsr*dchi-dh12*dspr; in k_resquared_ellipsoid_sphere() local
377 tor.z -= (dUa*Ua+dUr*Ur); in k_resquared_ellipsoid_sphere()
560 numtyp dUr = pbsr*dchi-dh12*dspr; in k_resquared_sphere_ellipsoid() local
561 numtyp force=dUr*Ur+dUa*Ua; in k_resquared_sphere_ellipsoid()
/dports/science/thermofun/thermofun-0.3.8/ThermoFun/Reactions/
H A DDolejsManning2010.cpp35 auto dUr = dHr - Pbar*dVr; in thermoPropertiesDolejsManning2010() local
36 auto dAr = dUr - TK*dSr; in thermoPropertiesDolejsManning2010()
48 tpr.reaction_internal_energy = dUr; in thermoPropertiesDolejsManning2010()
H A DLogK_function_of_T.cpp107 Reaktoro_::ThermoScalar dUr, dAr; in thermoPropertiesReaction_LogK_fT() local
110 dUr = dHr - Pbar*dVr; in thermoPropertiesReaction_LogK_fT()
111 dAr = dUr - TK*dSr; in thermoPropertiesReaction_LogK_fT()
123 tpr.reaction_internal_energy = dUr; in thermoPropertiesReaction_LogK_fT()
H A DFrantzMarshall.cpp46 auto dUr = dHr - Pbar*dVr; in thermoPropertiesFrantzMarshall() local
47 auto dAr = dUr - TK*dSr; in thermoPropertiesFrantzMarshall()
56 tpr.reaction_internal_energy = dUr; in thermoPropertiesFrantzMarshall()
H A DRyzhenkoBryzgalyn.cpp65 auto dUr = dHr - Pbar*dVr; in thermoPropertiesRyzhenkoBryzgalin() local
66 auto dAr = dUr - TK*dSr; in thermoPropertiesRyzhenkoBryzgalin()
76 tpr.reaction_internal_energy = dUr; in thermoPropertiesRyzhenkoBryzgalin()
/dports/math/scilab/scilab-6.1.1/scilab/modules/cacsd/sci_gateway/cpp/
H A Dsci_freq.cpp273 double dUr = 0; in freqRational() local
288 C2F(horner)(pdblDen[j], piRankDen + j, pdblF, pdblFImg, &dUr, &dUi); in freqRational()
289 if (dUr * dUr + dUi * dUi == 0) in freqRational()
297 C2F(wdiv)(&dVr, &dVi, &dUr, &dUi, pdblRTemp, pdblITemp); in freqRational()
301 *pdblRTemp = dVr / dUr; in freqRational()
/dports/devel/upp/upp/uppsrc/CtrlLib/src.tpp/
H A DSuggestCtrl_en-us.tpp20 …UJQ+MsAtSv1i5PrlL3/5u9/97sSJE1nF8v367rvv2tvbZTIZ+ln0g+vVYUofkOhJqZ70BpP1Zz/dUr/KdIqtxa8yb31GjpKWtM…
/dports/science/lammps/lammps-stable_29Sep2021/src/INTEL/
H A Dpair_gayberne_intel.cpp582 ME_cross3(tempv, tempv2, dUr); in eval()
/dports/math/py-seriate/seriate-1.1.2/doc/
H A Dimage_example.ipynb65 …\nVPH7dwfwf9sHMGDYhGrV3AI8cMulmGM8vc8ANari0O5GhIZHUbK4CLlzc7iyX370Jdz7bnX8/dUr\nPoTBEbNr3+uO4Pmjz8…
301 …\nVPH7dwfwf9sHMGDYhGrV3AI8cMulmGM8vc8ANari0O5GhIZHUbK4CLlzc7iyX370Jdz7bnX8/dUr\nPoTBEbNr3+uO4Pmjz8…
/dports/textproc/opensearch-dashboards/opensearch-dashboards-1.2.0-linux-x64/plugins/anomalyDetectionDashboards/node_modules/prettier/esm/
H A Dparser-flow.mjs22dUr=wB(Vl),hUr=[0,[17,0,0],wB(kv)],yUr=[0,[17,[0,wB(hd),1,0],[12,Rm,[17,0,0]]],wB(ak)],_Ur=[0,[15,…
/dports/math/py-mathics/Mathics3-2.2.0/mathics/doc/xml/
H A Ddata45024 …ytescnSR2QCyGhkzltirfb29sIxTKZAedwYXCysGFu06T0OHcVO5mCP7hbyHCUypT1jVLFfvQq+dUr+/GZ6hlvg5+nIRNQcJkb…
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/dports/security/hashcat-legacy/hashcat-legacy-2.00/salts/
H A Dbrute-vbulletin.salt618818 dUr
/dports/databases/py-mysql-connector-python/mysql-connector-python-8.0.27/tests/data/
H A Drandom_big_bin.csv17245 3�Pr�^;���C##K�cĺ qOAo0��!�Ą��.��}�R�&?���W,>f��A��x��:�By�=Zul�I*È��38f7��q��&���dUr�…
/dports/math/py-heyoka/heyoka.py-0.16.0/doc/notebooks/
H A DThe Maxwell-Boltzmann distribution.ipynb420658 "vXu5L+dUr/37La1cOUDZ2dnq2LHjyXOc3TlwoO4cONCtWc4mPDxcfXr3Voun5srf1+iyFglq0KCB\\\n",
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