Searched refs:dedyk1 (Results 1 – 4 of 4) sorted by relevance
/dports/science/tinker/tinker/source/ |
H A D | echgdpl1.f | 50 real*8 dedxk1,dedyk1,dedzk1 local 156 dedyk1 = -sk1*termy - termyk 182 dedyk1 = dedyk1*taper + sk1*dtapery 196 decd(2,k1) = decd(2,k1) + dedyk1 213 vyy = yr1*dedyk1 + yr2*dedyk2 214 vzy = zr1*dedyk1 + zr2*dedyk2 309 dedyk1 = -sk1*termy - termyk 335 dedyk1 = dedyk1*taper + sk1*dtapery 349 decd(2,k1) = decd(2,k1) + dedyk1 367 vyy = yr1*dedyk1 + yr2*dedyk2 [all …]
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H A D | edipole1.f | 53 real*8 dedxk1,dedyk1,dedzk1 local 174 dedyk1 = -sk1*termy - termyk 203 dedyk1 = dedyk1*taper - sk1*dtapery 220 ded(2,k1) = ded(2,k1) + dedyk1 239 vyy = yq1*dedyk1 + yq2*dedyk2 240 vzy = 0.5d0 * (zq1*dedyk1 + zq2*dedyk2 361 dedyk1 = -sk1*termy - termyk 390 dedyk1 = dedyk1*taper - sk1*dtapery 409 ded(2,k1) = ded(2,k1) + dedyk1 429 vyy = yq1*dedyk1 + yq2*dedyk2 [all …]
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H A D | echgdpl2.f | 49 real*8 dedxk1,dedyk1,dedzk1 local 181 dedyk1 = -sk1*termy + termyk 303 hessx(2,k1) = hessx(2,k1) + dtaperx*dedyk1 321 hessy(2,k1) = hessy(2,k1) + dtapery*dedyk1 339 hessz(2,k1) = hessz(2,k1) + dtaperz*dedyk1 435 dedyk1 = -sk1*termy + termyk 661 & + dtaperx*dedyk1 - sk1*d2taperxy 663 & + dtapery*dedyk1 - sk1*d2taperyy 665 & + dtaperz*dedyk1 - sk1*d2taperyz 845 dedyk1 = -sk1*termy + termyk [all …]
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H A D | edipole2.f | 64 real*8 dedxk1,dedyk1,dedzk1 local 246 dedyk1 = -sk1*termy - termyk 592 & + si1*dtaperx*dedyk1 - sk1*si1*d2taperxy 616 & + si1*dtapery*dedyk1 - sk1*si1*d2taperyy 640 & + si1*dtaperz*dedyk1 - sk1*si1*d2taperyz 665 & + si2*dtaperx*dedyk1 - sk1*si2*d2taperxy 689 & + si2*dtapery*dedyk1 - sk1*si2*d2taperyy 713 & + si2*dtaperz*dedyk1 - sk1*si2*d2taperyz 884 dedyk1 = -sk1*termy - termyk 1230 & + si1*dtaperx*dedyk1 - sk1*si1*d2taperxy [all …]
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