mirror of https://github.com/QMCPACK/qmcpack.git
Make descent test shorter
This commit is contained in:
Leon Otis
parent
80c32b1fa7
commit
cfa6679666
|
|
@ -146,7 +146,7 @@ IF (NOT QMC_CUDA)
|
|||
MESSAGE("Skipping H4_ae adaptive optimizer tests because lmyengine interface was not built (BUILD_LMYENGINE_INTERFACE=0)")
|
||||
ENDIF(BUILD_LMYENGINE_INTERFACE)
|
||||
|
||||
LIST(APPEND H4_DESCENT_SCALARS "totenergy" "-2.136347 0.0029")
|
||||
LIST(APPEND H4_DESCENT_SCALARS "totenergy" "-2.089256 0.003")
|
||||
|
||||
QMC_RUN_AND_CHECK(short-H4-descent
|
||||
"${CMAKE_SOURCE_DIR}/tests/molecules/H4_ae"
|
||||
|
|
@ -154,7 +154,7 @@ IF (NOT QMC_CUDA)
|
|||
optm-descent.xml
|
||||
16 1
|
||||
${MP_SUCCESS}
|
||||
50 H4_DESCENT_SCALARS
|
||||
9 H4_DESCENT_SCALARS
|
||||
TRUE)
|
||||
|
||||
QMC_RUN_AND_CHECK(short-H4-descent
|
||||
|
|
@ -163,7 +163,7 @@ IF (NOT QMC_CUDA)
|
|||
optm-descent.xml
|
||||
1 16
|
||||
${MP_SUCCESS}
|
||||
50 H4_DESCENT_SCALARS
|
||||
9 H4_DESCENT_SCALARS
|
||||
TRUE)
|
||||
|
||||
|
||||
|
|
|
|||
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
File diff suppressed because it is too large
Load Diff
|
|
@ -1,201 +0,0 @@
|
|||
# index LocalEnergy LocalEnergy_sq LocalPotential Kinetic ElecElec IonElec IonIon BlockWeight BlockCPU AcceptRatio
|
||||
0 -2.1325143616e+00 4.7076392011e+00 -4.2274380285e+00 2.0949236670e+00 1.8315630104e+00 -7.9310156336e+00 1.8720145947e+00 2.0000000000e+05 5.7039949787e-01 9.8835125000e-01
|
||||
1 -2.1336710476e+00 4.7169798111e+00 -4.2523780441e+00 2.1187069966e+00 1.8399404314e+00 -7.9643330702e+00 1.8720145947e+00 2.0000000000e+05 5.6957249669e-01 9.8797875000e-01
|
||||
2 -2.1343682865e+00 4.7160317823e+00 -4.2345622403e+00 2.1001939538e+00 1.8311500756e+00 -7.9377269105e+00 1.8720145947e+00 2.0000000000e+05 5.7130118250e-01 9.8831875000e-01
|
||||
3 -2.1426086792e+00 4.7478051135e+00 -4.2328467652e+00 2.0902380860e+00 1.8309227891e+00 -7.9357841490e+00 1.8720145947e+00 2.0000000000e+05 5.6879981491e-01 9.8834875000e-01
|
||||
4 -2.1431620639e+00 4.7521255886e+00 -4.2344792021e+00 2.0913171382e+00 1.8312048635e+00 -7.9376986602e+00 1.8720145947e+00 2.0000000000e+05 5.6944046170e-01 9.8849000000e-01
|
||||
5 -2.1340371628e+00 4.7166593188e+00 -4.2233926902e+00 2.0893555274e+00 1.8385786427e+00 -7.9339859275e+00 1.8720145947e+00 2.0000000000e+05 5.7048503053e-01 9.8837500000e-01
|
||||
6 -2.1373833312e+00 4.7308346595e+00 -4.2279116237e+00 2.0905282925e+00 1.8413692948e+00 -7.9412955131e+00 1.8720145947e+00 2.0000000000e+05 5.6993341679e-01 9.8841875000e-01
|
||||
7 -2.1292992362e+00 4.7082078839e+00 -4.2440928394e+00 2.1147936032e+00 1.8407374761e+00 -7.9568449102e+00 1.8720145947e+00 2.0000000000e+05 5.7130199159e-01 9.8804125000e-01
|
||||
8 -2.1388148091e+00 4.7353101687e+00 -4.2279411079e+00 2.0891262987e+00 1.8491067884e+00 -7.9490624909e+00 1.8720145947e+00 2.0000000000e+05 5.7193755684e-01 9.8825000000e-01
|
||||
9 -2.1355031152e+00 4.7191761742e+00 -4.2276757733e+00 2.0921726582e+00 1.8354419101e+00 -7.9351322781e+00 1.8720145947e+00 2.0000000000e+05 5.6963225710e-01 9.8824000000e-01
|
||||
10 -2.1356562180e+00 4.7205127441e+00 -4.2254429626e+00 2.0897867446e+00 1.8367873445e+00 -7.9342449017e+00 1.8720145947e+00 2.0000000000e+05 5.7072956976e-01 9.8832375000e-01
|
||||
11 -2.1339709959e+00 4.7146161023e+00 -4.2309347418e+00 2.0969637459e+00 1.8385591468e+00 -7.9415084832e+00 1.8720145947e+00 2.0000000000e+05 5.7050717948e-01 9.8818375000e-01
|
||||
12 -2.1337872313e+00 4.7147144350e+00 -4.2298633594e+00 2.0960761281e+00 1.8484628402e+00 -7.9503407943e+00 1.8720145947e+00 2.0000000000e+05 5.6873727287e-01 9.8804000000e-01
|
||||
13 -2.1342392577e+00 4.7129650388e+00 -4.2463514005e+00 2.1121121428e+00 1.8384031420e+00 -7.9567691371e+00 1.8720145947e+00 2.0000000000e+05 5.6850123289e-01 9.8813375000e-01
|
||||
14 -2.1423897040e+00 4.7516535020e+00 -4.2222125314e+00 2.0798228274e+00 1.8321256306e+00 -7.9263527566e+00 1.8720145947e+00 2.0000000000e+05 5.7000569277e-01 9.8831625000e-01
|
||||
15 -2.1402265748e+00 4.7445794535e+00 -4.1914976185e+00 2.0512710437e+00 1.8325062006e+00 -7.8960184138e+00 1.8720145947e+00 2.0000000000e+05 5.7000109786e-01 9.8826500000e-01
|
||||
16 -2.1367268505e+00 4.7237794404e+00 -4.2338816283e+00 2.0971547779e+00 1.8390888401e+00 -7.9449850631e+00 1.8720145947e+00 2.0000000000e+05 5.6925498997e-01 9.8850375000e-01
|
||||
17 -2.1375205680e+00 4.7372868940e+00 -4.2372728976e+00 2.0997523295e+00 1.8299774370e+00 -7.9392649292e+00 1.8720145947e+00 2.0000000000e+05 5.7016597106e-01 9.8828875000e-01
|
||||
18 -2.1354374475e+00 4.7200662792e+00 -4.2089582438e+00 2.0735207963e+00 1.8433700375e+00 -7.9243428760e+00 1.8720145947e+00 2.0000000000e+05 5.6966299913e-01 9.8830125000e-01
|
||||
19 -2.1325038128e+00 4.7122300467e+00 -4.2337945420e+00 2.1012907292e+00 1.8404999880e+00 -7.9463091246e+00 1.8720145947e+00 2.0000000000e+05 5.7303594379e-01 9.8800625000e-01
|
||||
20 -2.1438916625e+00 4.7572752266e+00 -4.2203160223e+00 2.0764243598e+00 1.8340240318e+00 -7.9263546487e+00 1.8720145947e+00 2.0000000000e+05 5.7066564681e-01 9.8840250000e-01
|
||||
21 -2.1333378366e+00 4.7162307998e+00 -4.2536458569e+00 2.1203080203e+00 1.8446673615e+00 -7.9703278131e+00 1.8720145947e+00 2.0000000000e+05 5.6979851727e-01 9.8823125000e-01
|
||||
22 -2.1432786467e+00 4.7532521900e+00 -4.1880828068e+00 2.0448041601e+00 1.8357420486e+00 -7.8958394500e+00 1.8720145947e+00 2.0000000000e+05 5.7111612102e-01 9.8838000000e-01
|
||||
23 -2.1326248005e+00 4.7120216831e+00 -4.2441215909e+00 2.1114967904e+00 1.8453831567e+00 -7.9615193422e+00 1.8720145947e+00 2.0000000000e+05 5.7120877947e-01 9.8820500000e-01
|
||||
24 -2.1348820532e+00 4.7189592541e+00 -4.2405997133e+00 2.1057176601e+00 1.8364278600e+00 -7.9490421680e+00 1.8720145947e+00 2.0000000000e+05 5.6982503715e-01 9.8812125000e-01
|
||||
25 -2.1360286386e+00 4.7214639697e+00 -4.2198971752e+00 2.0838685366e+00 1.8353892733e+00 -7.9273010432e+00 1.8720145947e+00 2.0000000000e+05 5.6949685956e-01 9.8822750000e-01
|
||||
26 -2.1412991907e+00 4.7476296038e+00 -4.2313942306e+00 2.0900950398e+00 1.8414716737e+00 -7.9448804989e+00 1.8720145947e+00 2.0000000000e+05 5.7351806411e-01 9.8825750000e-01
|
||||
27 -2.1425706506e+00 4.7511377275e+00 -4.2299399288e+00 2.0873692782e+00 1.8467804051e+00 -7.9487349286e+00 1.8720145947e+00 2.0000000000e+05 5.7127495995e-01 9.8832750000e-01
|
||||
28 -2.1367428731e+00 4.7272228091e+00 -4.2173462801e+00 2.0806034069e+00 1.8373654756e+00 -7.9267263504e+00 1.8720145947e+00 2.0000000000e+05 5.7018032460e-01 9.8831625000e-01
|
||||
29 -2.1374904929e+00 4.7263400030e+00 -4.2331751063e+00 2.0956846134e+00 1.8375978416e+00 -7.9427875425e+00 1.8720145947e+00 2.0000000000e+05 5.7141277310e-01 9.8836375000e-01
|
||||
30 -2.1419926748e+00 4.7485629305e+00 -4.2378703872e+00 2.0958777125e+00 1.8328101789e+00 -7.9426951608e+00 1.8720145947e+00 2.0000000000e+05 5.6962032011e-01 9.8823375000e-01
|
||||
31 -2.1350557434e+00 4.7162868255e+00 -4.1966413715e+00 2.0615856281e+00 1.8234112202e+00 -7.8920671864e+00 1.8720145947e+00 2.0000000000e+05 5.7174852258e-01 9.8844875000e-01
|
||||
32 -2.1362500584e+00 4.7246405650e+00 -4.2156474722e+00 2.0793974137e+00 1.8334490148e+00 -7.9211110817e+00 1.8720145947e+00 2.0000000000e+05 5.7165297307e-01 9.8839500000e-01
|
||||
33 -2.1342379752e+00 4.7181444171e+00 -4.2264947194e+00 2.0922567443e+00 1.8395776311e+00 -7.9380869451e+00 1.8720145947e+00 2.0000000000e+05 5.7058909372e-01 9.8840250000e-01
|
||||
34 -2.1282969308e+00 4.6879391128e+00 -4.2339645731e+00 2.1056676423e+00 1.8360878654e+00 -7.9420670331e+00 1.8720145947e+00 2.0000000000e+05 5.7065115776e-01 9.8805250000e-01
|
||||
35 -2.1338582997e+00 4.7134789065e+00 -4.1958118860e+00 2.0619535863e+00 1.8419206119e+00 -7.9097470925e+00 1.8720145947e+00 2.0000000000e+05 5.7121559652e-01 9.8811000000e-01
|
||||
36 -2.1297828946e+00 4.6937216927e+00 -4.2363653072e+00 2.1065824126e+00 1.8315514152e+00 -7.9399313170e+00 1.8720145947e+00 2.0000000000e+05 5.7228120766e-01 9.8807250000e-01
|
||||
37 -2.1368911745e+00 4.7297276314e+00 -4.2351329290e+00 2.0982417545e+00 1.8413789371e+00 -7.9485264608e+00 1.8720145947e+00 2.0000000000e+05 5.6924755429e-01 9.8846125000e-01
|
||||
38 -2.1361759225e+00 4.7241581568e+00 -4.2220854150e+00 2.0859094925e+00 1.8395936301e+00 -7.9336936397e+00 1.8720145947e+00 2.0000000000e+05 5.7096148888e-01 9.8817750000e-01
|
||||
39 -2.1382045521e+00 4.7322095462e+00 -4.2486491584e+00 2.1104446063e+00 1.8319794108e+00 -7.9526431639e+00 1.8720145947e+00 2.0000000000e+05 5.7064381149e-01 9.8809625000e-01
|
||||
40 -2.1398430634e+00 4.7365384222e+00 -4.2477028858e+00 2.1078598224e+00 1.8332529219e+00 -7.9529704024e+00 1.8720145947e+00 2.0000000000e+05 5.7021001494e-01 9.8806375000e-01
|
||||
41 -2.1354042755e+00 4.7200290829e+00 -4.2444649142e+00 2.1090606387e+00 1.8404467769e+00 -7.9569262858e+00 1.8720145947e+00 2.0000000000e+05 5.7233076193e-01 9.8824875000e-01
|
||||
42 -2.1354253352e+00 4.7258950806e+00 -4.2312473602e+00 2.0958220250e+00 1.8292551665e+00 -7.9325171214e+00 1.8720145947e+00 2.0000000000e+05 5.6998175243e-01 9.8832625000e-01
|
||||
43 -2.1385622331e+00 4.7333892379e+00 -4.2580594650e+00 2.1194972319e+00 1.8383662358e+00 -7.9684402955e+00 1.8720145947e+00 2.0000000000e+05 5.7055489905e-01 9.8804625000e-01
|
||||
44 -2.1411918597e+00 4.7476645604e+00 -4.2288289600e+00 2.0876371004e+00 1.8381964643e+00 -7.9390400189e+00 1.8720145947e+00 2.0000000000e+05 5.7525972929e-01 9.8790750000e-01
|
||||
45 -2.1344772715e+00 4.7230399837e+00 -4.2258293122e+00 2.0913520407e+00 1.8363657705e+00 -7.9342096774e+00 1.8720145947e+00 2.0000000000e+05 5.7081697322e-01 9.8844000000e-01
|
||||
46 -2.1343164791e+00 4.7152996853e+00 -4.2414351571e+00 2.1071186779e+00 1.8357135435e+00 -7.9491632952e+00 1.8720145947e+00 2.0000000000e+05 5.7029942959e-01 9.8841875000e-01
|
||||
47 -2.1332162710e+00 4.7106278153e+00 -4.2539661993e+00 2.1207499283e+00 1.8369415442e+00 -7.9629223382e+00 1.8720145947e+00 2.0000000000e+05 5.6953242118e-01 9.8795375000e-01
|
||||
48 -2.1333083040e+00 4.7174191775e+00 -4.2233710371e+00 2.0900627331e+00 1.8421255713e+00 -7.9375112030e+00 1.8720145947e+00 2.0000000000e+05 5.7013455033e-01 9.8822375000e-01
|
||||
49 -2.1402190636e+00 4.7420842590e+00 -4.2079736663e+00 2.0677546026e+00 1.8326691812e+00 -7.9126574421e+00 1.8720145947e+00 2.0000000000e+05 5.7078584679e-01 9.8844500000e-01
|
||||
50 -2.1436001858e+00 4.7600016631e+00 -4.2402523271e+00 2.0966521413e+00 1.8433222355e+00 -7.9555891572e+00 1.8720145947e+00 2.0000000000e+05 5.7489204034e-01 9.8812875000e-01
|
||||
51 -2.1298921655e+00 4.7006195913e+00 -4.2410712417e+00 2.1111790762e+00 1.8441199982e+00 -7.9572058345e+00 1.8720145947e+00 2.0000000000e+05 5.7055262220e-01 9.8836750000e-01
|
||||
52 -2.1426058091e+00 4.7510767181e+00 -4.2409330011e+00 2.0983271920e+00 1.8295508152e+00 -7.9424984110e+00 1.8720145947e+00 2.0000000000e+05 5.6903728680e-01 9.8829750000e-01
|
||||
53 -2.1398090617e+00 4.7360544198e+00 -4.2568129653e+00 2.1170039036e+00 1.8354427741e+00 -7.9642703341e+00 1.8720145947e+00 2.0000000000e+05 5.6901398161e-01 9.8834625000e-01
|
||||
54 -2.1409069774e+00 4.7404267156e+00 -4.2096054655e+00 2.0686984881e+00 1.8267498920e+00 -7.9083699522e+00 1.8720145947e+00 2.0000000000e+05 5.6856760592e-01 9.8829000000e-01
|
||||
55 -2.1374841203e+00 4.7261204710e+00 -4.2147973035e+00 2.0773131832e+00 1.8362670789e+00 -7.9230789771e+00 1.8720145947e+00 2.0000000000e+05 5.6935072108e-01 9.8825625000e-01
|
||||
56 -2.1346302130e+00 4.7179006238e+00 -4.2379391990e+00 2.1033089859e+00 1.8531855769e+00 -7.9631393705e+00 1.8720145947e+00 2.0000000000e+05 5.7046432397e-01 9.8798500000e-01
|
||||
57 -2.1362698066e+00 4.7256217048e+00 -4.2158089796e+00 2.0795391731e+00 1.8404867537e+00 -7.9283103280e+00 1.8720145947e+00 2.0000000000e+05 5.6849749223e-01 9.8842500000e-01
|
||||
58 -2.1403285785e+00 4.7420052196e+00 -4.1841062711e+00 2.0437776926e+00 1.8291414415e+00 -7.8852623073e+00 1.8720145947e+00 2.0000000000e+05 5.6946932035e-01 9.8842375000e-01
|
||||
59 -2.1371252589e+00 4.7262264875e+00 -4.2168084866e+00 2.0796832277e+00 1.8257266986e+00 -7.9145497799e+00 1.8720145947e+00 2.0000000000e+05 5.6893444946e-01 9.8852625000e-01
|
||||
60 -2.1363942000e+00 4.7224772963e+00 -4.2478974913e+00 2.1115032913e+00 1.8300493714e+00 -7.9499614573e+00 1.8720145947e+00 2.0000000000e+05 5.6982538756e-01 9.8810250000e-01
|
||||
61 -2.1401196393e+00 4.7381002629e+00 -4.2068791256e+00 2.0667594863e+00 1.8426302282e+00 -7.9215239484e+00 1.8720145947e+00 2.0000000000e+05 5.6857424136e-01 9.8845250000e-01
|
||||
62 -2.1361534979e+00 4.7288614359e+00 -4.2180648902e+00 2.0819113923e+00 1.8377492571e+00 -7.9278287420e+00 1.8720145947e+00 2.0000000000e+05 5.6977752456e-01 9.8855000000e-01
|
||||
63 -2.1418892069e+00 4.7485092283e+00 -4.2327273217e+00 2.0908381148e+00 1.8359768883e+00 -7.9407188046e+00 1.8720145947e+00 2.0000000000e+05 5.6813611113e-01 9.8840625000e-01
|
||||
64 -2.1341090807e+00 4.7138885078e+00 -4.2221671640e+00 2.0880580833e+00 1.8264529364e+00 -7.9206346950e+00 1.8720145947e+00 2.0000000000e+05 5.6911521521e-01 9.8813500000e-01
|
||||
65 -2.1329379177e+00 4.7098437977e+00 -4.2280733683e+00 2.0951354506e+00 1.8372734501e+00 -7.9373614131e+00 1.8720145947e+00 2.0000000000e+05 5.6856218539e-01 9.8837375000e-01
|
||||
66 -2.1388496004e+00 4.7323125759e+00 -4.1934520373e+00 2.0546024369e+00 1.8296962072e+00 -7.8951628391e+00 1.8720145947e+00 2.0000000000e+05 5.6943467702e-01 9.8810500000e-01
|
||||
67 -2.1305648261e+00 4.6994214524e+00 -4.2362817428e+00 2.1057169167e+00 1.8339603733e+00 -7.9422567108e+00 1.8720145947e+00 2.0000000000e+05 5.6946992315e-01 9.8848375000e-01
|
||||
68 -2.1374206202e+00 4.7297840223e+00 -4.2209047871e+00 2.0834841669e+00 1.8367014825e+00 -7.9296208642e+00 1.8720145947e+00 2.0000000000e+05 5.6965384376e-01 9.8822375000e-01
|
||||
69 -2.1410037235e+00 4.7436199197e+00 -4.2207140450e+00 2.0797103216e+00 1.8406938613e+00 -7.9334225010e+00 1.8720145947e+00 2.0000000000e+05 5.6977421232e-01 9.8844125000e-01
|
||||
70 -2.1336750313e+00 4.7132616126e+00 -4.2472902222e+00 2.1136151909e+00 1.8376629706e+00 -7.9569677874e+00 1.8720145947e+00 2.0000000000e+05 5.7203434128e-01 9.8815750000e-01
|
||||
71 -2.1383193547e+00 4.7356427329e+00 -4.2313470156e+00 2.0930276609e+00 1.8372565043e+00 -7.9406181145e+00 1.8720145947e+00 2.0000000000e+05 5.6839267770e-01 9.8821500000e-01
|
||||
72 -2.1343258017e+00 4.7254485988e+00 -4.2362256987e+00 2.1018998970e+00 1.8397149763e+00 -7.9479552696e+00 1.8720145947e+00 2.0000000000e+05 5.7238520565e-01 9.8800000000e-01
|
||||
73 -2.1359598162e+00 4.7255613418e+00 -4.1991408922e+00 2.0631810760e+00 1.8345163640e+00 -7.9056718508e+00 1.8720145947e+00 2.0000000000e+05 5.6898153201e-01 9.8829625000e-01
|
||||
74 -2.1383667880e+00 4.7328565163e+00 -4.2339866849e+00 2.0956198969e+00 1.8345382507e+00 -7.9405395302e+00 1.8720145947e+00 2.0000000000e+05 5.7033856167e-01 9.8857625000e-01
|
||||
75 -2.1273120756e+00 4.6869428734e+00 -4.2496935286e+00 2.1223814530e+00 1.8507797359e+00 -7.9724878592e+00 1.8720145947e+00 2.0000000000e+05 5.6879858021e-01 9.8823625000e-01
|
||||
76 -2.1384636714e+00 4.7336078606e+00 -4.2294006269e+00 2.0909369555e+00 1.8346567614e+00 -7.9360719829e+00 1.8720145947e+00 2.0000000000e+05 5.7002525451e-01 9.8825000000e-01
|
||||
77 -2.1334454843e+00 4.7134613015e+00 -4.2446286317e+00 2.1111831474e+00 1.8452422407e+00 -7.9618854670e+00 1.8720145947e+00 2.0000000000e+05 5.6952452823e-01 9.8838625000e-01
|
||||
78 -2.1382150375e+00 4.7299099117e+00 -4.2212077371e+00 2.0829926996e+00 1.8417020947e+00 -7.9349244264e+00 1.8720145947e+00 2.0000000000e+05 5.7009730907e-01 9.8839750000e-01
|
||||
79 -2.1338980540e+00 4.7132143755e+00 -4.2283225990e+00 2.0944245450e+00 1.8311369830e+00 -7.9314741767e+00 1.8720145947e+00 2.0000000000e+05 5.6991283479e-01 9.8800875000e-01
|
||||
80 -2.1309899017e+00 4.7040088919e+00 -4.2317768049e+00 2.1007869033e+00 1.8375465588e+00 -7.9413379584e+00 1.8720145947e+00 2.0000000000e+05 5.7013738668e-01 9.8830500000e-01
|
||||
81 -2.1426206613e+00 4.7512165270e+00 -4.2365480530e+00 2.0939273917e+00 1.8320254086e+00 -7.9405880563e+00 1.8720145947e+00 2.0000000000e+05 5.6910807290e-01 9.8816875000e-01
|
||||
82 -2.1358466965e+00 4.7228700864e+00 -4.2459569725e+00 2.1101102760e+00 1.8445219835e+00 -7.9624935506e+00 1.8720145947e+00 2.0000000000e+05 5.6852405309e-01 9.8821625000e-01
|
||||
83 -2.1302242777e+00 4.7017184562e+00 -4.2509265015e+00 2.1207022237e+00 1.8351083903e+00 -7.9580494864e+00 1.8720145947e+00 2.0000000000e+05 5.6826515356e-01 9.8804375000e-01
|
||||
84 -2.1371492835e+00 4.7279105335e+00 -4.2210067334e+00 2.0838574499e+00 1.8310214335e+00 -7.9240427616e+00 1.8720145947e+00 2.0000000000e+05 5.6960629276e-01 9.8834500000e-01
|
||||
85 -2.1343004328e+00 4.7180587384e+00 -4.2111048360e+00 2.0768044032e+00 1.8364408351e+00 -7.9195602658e+00 1.8720145947e+00 2.0000000000e+05 5.6978028780e-01 9.8831375000e-01
|
||||
86 -2.1385226161e+00 4.7321600026e+00 -4.2122755050e+00 2.0737528889e+00 1.8343984238e+00 -7.9186885235e+00 1.8720145947e+00 2.0000000000e+05 5.7114472589e-01 9.8827250000e-01
|
||||
87 -2.1391144456e+00 4.7376578916e+00 -4.2212141124e+00 2.0820996669e+00 1.8394436712e+00 -7.9326723783e+00 1.8720145947e+00 2.0000000000e+05 5.7026759116e-01 9.8821000000e-01
|
||||
88 -2.1400754073e+00 4.7389425344e+00 -4.2168903607e+00 2.0768149534e+00 1.8257791786e+00 -7.9146841339e+00 1.8720145947e+00 2.0000000000e+05 5.6877344567e-01 9.8824000000e-01
|
||||
89 -2.1427207014e+00 4.7506147344e+00 -4.2129065305e+00 2.0701858291e+00 1.8325742221e+00 -7.9174953473e+00 1.8720145947e+00 2.0000000000e+05 5.7338474109e-01 9.8827750000e-01
|
||||
90 -2.1410602405e+00 4.7439193852e+00 -4.2635884640e+00 2.1225282235e+00 1.8300493364e+00 -7.9656523950e+00 1.8720145947e+00 2.0000000000e+05 5.6965467101e-01 9.8813500000e-01
|
||||
91 -2.1391345127e+00 4.7360161690e+00 -4.2304424320e+00 2.0913079194e+00 1.8305499757e+00 -7.9330070023e+00 1.8720145947e+00 2.0000000000e+05 5.7053388562e-01 9.8814250000e-01
|
||||
92 -2.1344776952e+00 4.7184190168e+00 -4.2459052328e+00 2.1114275376e+00 1.8485352745e+00 -7.9664551020e+00 1.8720145947e+00 2.0000000000e+05 5.6954999571e-01 9.8818000000e-01
|
||||
93 -2.1339599328e+00 4.7160042613e+00 -4.2403977123e+00 2.1064377795e+00 1.8370749777e+00 -7.9494872846e+00 1.8720145947e+00 2.0000000000e+05 5.6930410140e-01 9.8821000000e-01
|
||||
94 -2.1345742562e+00 4.7168907466e+00 -4.2251077679e+00 2.0905335118e+00 1.8342671683e+00 -7.9313895308e+00 1.8720145947e+00 2.0000000000e+05 5.7038319786e-01 9.8819250000e-01
|
||||
95 -2.1413539893e+00 4.7497868530e+00 -4.1893406361e+00 2.0479866468e+00 1.8356486628e+00 -7.8970038935e+00 1.8720145947e+00 2.0000000000e+05 5.6892989948e-01 9.8842750000e-01
|
||||
96 -2.1350325689e+00 4.7195362333e+00 -4.2391545176e+00 2.1041219487e+00 1.8297992224e+00 -7.9409683346e+00 1.8720145947e+00 2.0000000000e+05 5.7006519311e-01 9.8822250000e-01
|
||||
97 -2.1329191644e+00 4.7100416092e+00 -4.1934612174e+00 2.0605420530e+00 1.8413496879e+00 -7.9068254999e+00 1.8720145947e+00 2.0000000000e+05 5.6802595616e-01 9.8836375000e-01
|
||||
98 -2.1355521472e+00 4.7213831776e+00 -4.2089794034e+00 2.0734272562e+00 1.8441482374e+00 -7.9251422355e+00 1.8720145947e+00 2.0000000000e+05 5.6900957250e-01 9.8835375000e-01
|
||||
99 -2.1356900560e+00 4.7293550084e+00 -4.2163094895e+00 2.0806194335e+00 1.8399162481e+00 -7.9282403322e+00 1.8720145947e+00 2.0000000000e+05 5.7559781102e-01 9.8828125000e-01
|
||||
100 -2.1360118491e+00 4.7204982763e+00 -4.2296020090e+00 2.0935901599e+00 1.8280972425e+00 -7.9297138461e+00 1.8720145947e+00 2.0000000000e+05 5.7853342197e-01 9.8829875000e-01
|
||||
101 -2.1378883372e+00 4.7281833078e+00 -4.2410172010e+00 2.1031288638e+00 1.8331160200e+00 -7.9461478157e+00 1.8720145947e+00 2.0000000000e+05 5.7413901645e-01 9.8828250000e-01
|
||||
102 -2.1362600473e+00 4.7271813489e+00 -4.2538399324e+00 2.1175798852e+00 1.8378910485e+00 -7.9637455755e+00 1.8720145947e+00 2.0000000000e+05 5.6985725556e-01 9.8810000000e-01
|
||||
103 -2.1383181189e+00 4.7312855926e+00 -4.2445450370e+00 2.1062269182e+00 1.8354430432e+00 -7.9520026748e+00 1.8720145947e+00 2.0000000000e+05 5.6977958325e-01 9.8806250000e-01
|
||||
104 -2.1289599411e+00 4.6926462590e+00 -4.2185634019e+00 2.0896034608e+00 1.8369504912e+00 -7.9275284877e+00 1.8720145947e+00 2.0000000000e+05 5.6993575860e-01 9.8835250000e-01
|
||||
105 -2.1383465578e+00 4.7344905651e+00 -4.2146497001e+00 2.0763031423e+00 1.8338602192e+00 -7.9205245139e+00 1.8720145947e+00 2.0000000000e+05 5.6958026858e-01 9.8837875000e-01
|
||||
106 -2.1383653319e+00 4.7334960062e+00 -4.2355236230e+00 2.0971582911e+00 1.8366390319e+00 -7.9441772495e+00 1.8720145947e+00 2.0000000000e+05 5.6868903711e-01 9.8804250000e-01
|
||||
107 -2.1301697723e+00 4.6998054605e+00 -4.2605971313e+00 2.1304273591e+00 1.8403175693e+00 -7.9729292953e+00 1.8720145947e+00 2.0000000000e+05 5.6952401064e-01 9.8796250000e-01
|
||||
108 -2.1388934228e+00 4.7351376602e+00 -4.2003577128e+00 2.0614642900e+00 1.8370045007e+00 -7.9093768082e+00 1.8720145947e+00 2.0000000000e+05 5.7093180786e-01 9.8833500000e-01
|
||||
109 -2.1272548133e+00 4.6858343628e+00 -4.2402767015e+00 2.1130218882e+00 1.8340691812e+00 -7.9463604774e+00 1.8720145947e+00 2.0000000000e+05 5.7022669492e-01 9.8817000000e-01
|
||||
110 -2.1380364785e+00 4.7326613577e+00 -4.2442335523e+00 2.1061970739e+00 1.8410782169e+00 -7.9573263639e+00 1.8720145947e+00 2.0000000000e+05 5.6922764517e-01 9.8841250000e-01
|
||||
111 -2.1339318149e+00 4.7141162376e+00 -4.2105609300e+00 2.0766291151e+00 1.8338980306e+00 -7.9164735553e+00 1.8720145947e+00 2.0000000000e+05 5.7049562782e-01 9.8827000000e-01
|
||||
112 -2.1378281335e+00 4.7323843057e+00 -4.2218225185e+00 2.0839943850e+00 1.8400268653e+00 -7.9338639785e+00 1.8720145947e+00 2.0000000000e+05 5.6925514434e-01 9.8819250000e-01
|
||||
113 -2.1352575237e+00 4.7192475602e+00 -4.2324147408e+00 2.0971572171e+00 1.8389341213e+00 -7.9433634567e+00 1.8720145947e+00 2.0000000000e+05 5.6957793632e-01 9.8835875000e-01
|
||||
114 -2.1426543521e+00 4.7514282671e+00 -4.2489862072e+00 2.1063318551e+00 1.8444708467e+00 -7.9654716486e+00 1.8720145947e+00 2.0000000000e+05 5.6846383563e-01 9.8814500000e-01
|
||||
115 -2.1348128657e+00 4.7244688637e+00 -4.2282954442e+00 2.0934825785e+00 1.8433051314e+00 -7.9436151703e+00 1.8720145947e+00 2.0000000000e+05 5.7029300393e-01 9.8825250000e-01
|
||||
116 -2.1445908990e+00 4.7584643974e+00 -4.2165389190e+00 2.0719480200e+00 1.8320748493e+00 -7.9206283630e+00 1.8720145947e+00 2.0000000000e+05 5.7050922792e-01 9.8825625000e-01
|
||||
117 -2.1318857532e+00 4.7057183626e+00 -4.2488293763e+00 2.1169436232e+00 1.8384633953e+00 -7.9593073663e+00 1.8720145947e+00 2.0000000000e+05 5.6965740933e-01 9.8812625000e-01
|
||||
118 -2.1320963524e+00 4.7058944321e+00 -4.1976871776e+00 2.0655908252e+00 1.8446302270e+00 -7.9143319993e+00 1.8720145947e+00 2.0000000000e+05 5.6981378887e-01 9.8833500000e-01
|
||||
119 -2.1373551378e+00 4.7270575758e+00 -4.2180936390e+00 2.0807385011e+00 1.8369193164e+00 -7.9270275501e+00 1.8720145947e+00 2.0000000000e+05 5.6886582403e-01 9.8841750000e-01
|
||||
120 -2.1275912095e+00 4.6883989034e+00 -4.2187810762e+00 2.0911898668e+00 1.8387872454e+00 -7.9295829163e+00 1.8720145947e+00 2.0000000000e+05 5.7019929308e-01 9.8820375000e-01
|
||||
121 -2.1310141706e+00 4.7027987934e+00 -4.2699717787e+00 2.1389576080e+00 1.8424482129e+00 -7.9844345863e+00 1.8720145947e+00 2.0000000000e+05 5.7228374900e-01 9.8804250000e-01
|
||||
122 -2.1412025525e+00 4.7488486668e+00 -4.2369653498e+00 2.0957627973e+00 1.8374538618e+00 -7.9464338062e+00 1.8720145947e+00 2.0000000000e+05 5.6917111389e-01 9.8823875000e-01
|
||||
123 -2.1332993378e+00 4.7166824796e+00 -4.2598665692e+00 2.1265672314e+00 1.8479799397e+00 -7.9798611036e+00 1.8720145947e+00 2.0000000000e+05 5.6955410982e-01 9.8822500000e-01
|
||||
124 -2.1356887230e+00 4.7184201338e+00 -4.2396806361e+00 2.1039919131e+00 1.8368859973e+00 -7.9485812280e+00 1.8720145947e+00 2.0000000000e+05 5.6937610940e-01 9.8820875000e-01
|
||||
125 -2.1439647810e+00 4.7549714908e+00 -4.2187143797e+00 2.0747495987e+00 1.8306541041e+00 -7.9213830785e+00 1.8720145947e+00 2.0000000000e+05 5.7009882201e-01 9.8812750000e-01
|
||||
126 -2.1398667776e+00 4.7404826761e+00 -4.1907367017e+00 2.0508699241e+00 1.8389631118e+00 -7.9017144081e+00 1.8720145947e+00 2.0000000000e+05 5.6784140039e-01 9.8842500000e-01
|
||||
127 -2.1319337496e+00 4.7121444718e+00 -4.2187602532e+00 2.0868265036e+00 1.8471998514e+00 -7.9379746992e+00 1.8720145947e+00 2.0000000000e+05 5.6965100206e-01 9.8830375000e-01
|
||||
128 -2.1383266287e+00 4.7402950948e+00 -4.2308605783e+00 2.0925339496e+00 1.8502188494e+00 -7.9530940223e+00 1.8720145947e+00 2.0000000000e+05 5.7167866896e-01 9.8813625000e-01
|
||||
129 -2.1361581510e+00 4.7228571580e+00 -4.2045923503e+00 2.0684341993e+00 1.8334300477e+00 -7.9100369926e+00 1.8720145947e+00 2.0000000000e+05 5.6858641538e-01 9.8807125000e-01
|
||||
130 -2.1347495382e+00 4.7178292560e+00 -4.2092530839e+00 2.0745035457e+00 1.8356413926e+00 -7.9169090711e+00 1.8720145947e+00 2.0000000000e+05 5.6908628996e-01 9.8824750000e-01
|
||||
131 -2.1334543578e+00 4.7122083342e+00 -4.2629289560e+00 2.1294745983e+00 1.8423612007e+00 -7.9773047513e+00 1.8720145947e+00 2.0000000000e+05 5.6899150880e-01 9.8820625000e-01
|
||||
132 -2.1398353700e+00 4.7354239943e+00 -4.2171620291e+00 2.0773266591e+00 1.8332234913e+00 -7.9224001151e+00 1.8720145947e+00 2.0000000000e+05 5.7039160607e-01 9.8814750000e-01
|
||||
133 -2.1350373555e+00 4.7207005610e+00 -4.2430452127e+00 2.1080078572e+00 1.8327021382e+00 -7.9477619456e+00 1.8720145947e+00 2.0000000000e+05 5.6975109852e-01 9.8824125000e-01
|
||||
134 -2.1367545244e+00 4.7251888475e+00 -4.2154916312e+00 2.0787371069e+00 1.8382668579e+00 -7.9257730838e+00 1.8720145947e+00 2.0000000000e+05 5.6990707270e-01 9.8822750000e-01
|
||||
135 -2.1406553919e+00 4.7404561371e+00 -4.2398810606e+00 2.0992256687e+00 1.8321600676e+00 -7.9440557228e+00 1.8720145947e+00 2.0000000000e+05 5.6979852007e-01 9.8833875000e-01
|
||||
136 -2.1289555945e+00 4.6983572762e+00 -4.2242222080e+00 2.0952666135e+00 1.8350605888e+00 -7.9312973915e+00 1.8720145947e+00 2.0000000000e+05 5.6798172882e-01 9.8828875000e-01
|
||||
137 -2.1325678000e+00 4.7080874962e+00 -4.2476550901e+00 2.1150872901e+00 1.8324286354e+00 -7.9520983201e+00 1.8720145947e+00 2.0000000000e+05 5.7078573178e-01 9.8853750000e-01
|
||||
138 -2.1277384425e+00 4.6938653552e+00 -4.2649989182e+00 2.1372604758e+00 1.8500292795e+00 -7.9870427924e+00 1.8720145947e+00 2.0000000000e+05 5.6852466404e-01 9.8809875000e-01
|
||||
139 -2.1353319230e+00 4.7181078362e+00 -4.2248392963e+00 2.0895073733e+00 1.8389503098e+00 -7.9358042008e+00 1.8720145947e+00 2.0000000000e+05 5.7054420072e-01 9.8819500000e-01
|
||||
140 -2.1377703483e+00 4.7313985777e+00 -4.2228765734e+00 2.0851062251e+00 1.8457754771e+00 -7.9406666451e+00 1.8720145947e+00 2.0000000000e+05 5.6953026378e-01 9.8839125000e-01
|
||||
141 -2.1416092811e+00 4.7465818180e+00 -4.2394253895e+00 2.0978161084e+00 1.8392377682e+00 -7.9506777523e+00 1.8720145947e+00 2.0000000000e+05 5.6936140405e-01 9.8830375000e-01
|
||||
142 -2.1385766698e+00 4.7377467757e+00 -4.2595110636e+00 2.1209343938e+00 1.8383210834e+00 -7.9698467417e+00 1.8720145947e+00 2.0000000000e+05 5.6937581673e-01 9.8813875000e-01
|
||||
143 -2.1369758840e+00 4.7283606055e+00 -4.2245008569e+00 2.0875249730e+00 1.8343321920e+00 -7.9308476436e+00 1.8720145947e+00 2.0000000000e+05 5.6921618641e-01 9.8845000000e-01
|
||||
144 -2.1315718343e+00 4.7069013970e+00 -4.2050717493e+00 2.0734999149e+00 1.8445995796e+00 -7.9216859236e+00 1.8720145947e+00 2.0000000000e+05 5.7006588695e-01 9.8835625000e-01
|
||||
145 -2.1402514013e+00 4.7395930333e+00 -4.2342462665e+00 2.0939948652e+00 1.8395426332e+00 -7.9458034944e+00 1.8720145947e+00 2.0000000000e+05 5.6961281830e-01 9.8803750000e-01
|
||||
146 -2.1396617176e+00 4.7391784584e+00 -4.2083065245e+00 2.0686448069e+00 1.8414168013e+00 -7.9217379204e+00 1.8720145947e+00 2.0000000000e+05 5.6806660793e-01 9.8814625000e-01
|
||||
147 -2.1354820163e+00 4.7207809469e+00 -4.2252065425e+00 2.0897245262e+00 1.8376704915e+00 -7.9348916287e+00 1.8720145947e+00 2.0000000000e+05 5.7394572184e-01 9.8835250000e-01
|
||||
148 -2.1411271704e+00 4.7421644466e+00 -4.2269474778e+00 2.0858203074e+00 1.8400475429e+00 -7.9390096154e+00 1.8720145947e+00 2.0000000000e+05 5.6791887246e-01 9.8825000000e-01
|
||||
149 -2.1324327214e+00 4.7095873040e+00 -4.2287572212e+00 2.0963244998e+00 1.8333704353e+00 -7.9341422511e+00 1.8720145947e+00 2.0000000000e+05 5.6938795885e-01 9.8832375000e-01
|
||||
150 -2.1369159375e+00 4.7265583584e+00 -4.2502251090e+00 2.1133091714e+00 1.8384785647e+00 -7.9607182683e+00 1.8720145947e+00 2.0000000000e+05 5.6787587795e-01 9.8841875000e-01
|
||||
151 -2.1393119501e+00 4.7356181255e+00 -4.2403013454e+00 2.1009893952e+00 1.8336135069e+00 -7.9459294469e+00 1.8720145947e+00 2.0000000000e+05 5.6972732814e-01 9.8814625000e-01
|
||||
152 -2.1310221708e+00 4.7022336192e+00 -4.2503663472e+00 2.1193441763e+00 1.8402295773e+00 -7.9626105191e+00 1.8720145947e+00 2.0000000000e+05 5.7025822485e-01 9.8788750000e-01
|
||||
153 -2.1348382339e+00 4.7188176515e+00 -4.2194000030e+00 2.0845617691e+00 1.8351926293e+00 -7.9266072270e+00 1.8720145947e+00 2.0000000000e+05 5.6893616077e-01 9.8824625000e-01
|
||||
154 -2.1393439628e+00 4.7376487505e+00 -4.2216420135e+00 2.0822980507e+00 1.8367813110e+00 -7.9304379191e+00 1.8720145947e+00 2.0000000000e+05 5.9280449804e-01 9.8840500000e-01
|
||||
155 -2.1343485435e+00 4.7146134391e+00 -4.2221699969e+00 2.0878214535e+00 1.8434154122e+00 -7.9376000038e+00 1.8720145947e+00 2.0000000000e+05 5.7050563535e-01 9.8828375000e-01
|
||||
156 -2.1401125106e+00 4.7416635182e+00 -4.2259968658e+00 2.0858843552e+00 1.8319196305e+00 -7.9299310910e+00 1.8720145947e+00 2.0000000000e+05 5.6975054694e-01 9.8823500000e-01
|
||||
157 -2.1250834761e+00 4.6762864814e+00 -4.1920292233e+00 2.0669457472e+00 1.8261287223e+00 -7.8901725402e+00 1.8720145947e+00 2.0000000000e+05 5.6987577863e-01 9.8818500000e-01
|
||||
158 -2.1300804251e+00 4.6963192138e+00 -4.2099569836e+00 2.0798765585e+00 1.8367172120e+00 -7.9186887902e+00 1.8720145947e+00 2.0000000000e+05 5.6888003461e-01 9.8847625000e-01
|
||||
159 -2.1381269614e+00 4.7287979791e+00 -4.2141234984e+00 2.0759965370e+00 1.8252155851e+00 -7.9113536781e+00 1.8720145947e+00 2.0000000000e+05 5.6974019576e-01 9.8843375000e-01
|
||||
160 -2.1351108952e+00 4.7198482885e+00 -4.2329709263e+00 2.0978600310e+00 1.8407410433e+00 -7.9457265642e+00 1.8720145947e+00 2.0000000000e+05 5.6805752474e-01 9.8821625000e-01
|
||||
161 -2.1350997493e+00 4.7203648125e+00 -4.2521029667e+00 2.1170032174e+00 1.8434558763e+00 -7.9675734377e+00 1.8720145947e+00 2.0000000000e+05 5.7761446736e-01 9.8842250000e-01
|
||||
162 -2.1383017878e+00 4.7318942661e+00 -4.2360100930e+00 2.0977083052e+00 1.8378637240e+00 -7.9458884116e+00 1.8720145947e+00 2.0000000000e+05 5.6870052102e-01 9.8829250000e-01
|
||||
163 -2.1386165513e+00 4.7356547753e+00 -4.2140744554e+00 2.0754579041e+00 1.8378486320e+00 -7.9239376821e+00 1.8720145947e+00 2.0000000000e+05 5.6864669500e-01 9.8845500000e-01
|
||||
164 -2.1375805120e+00 4.7299261677e+00 -4.2223588836e+00 2.0847783716e+00 1.8390038018e+00 -7.9333772801e+00 1.8720145947e+00 2.0000000000e+05 5.6897962210e-01 9.8835750000e-01
|
||||
165 -2.1378202903e+00 4.7301343933e+00 -4.2343054379e+00 2.0964851476e+00 1.8315938399e+00 -7.9379138725e+00 1.8720145947e+00 2.0000000000e+05 5.6966596283e-01 9.8791750000e-01
|
||||
166 -2.1375751139e+00 4.7297562260e+00 -4.2058819650e+00 2.0683068511e+00 1.8416476531e+00 -7.9195442128e+00 1.8720145947e+00 2.0000000000e+05 5.7088494231e-01 9.8843000000e-01
|
||||
167 -2.1357304755e+00 4.7296600609e+00 -4.2034875840e+00 2.0677571084e+00 1.8267289391e+00 -7.9022311177e+00 1.8720145947e+00 2.0000000000e+05 5.6813663943e-01 9.8836375000e-01
|
||||
168 -2.1385153058e+00 4.7326659463e+00 -4.2193908349e+00 2.0808755291e+00 1.8384780703e+00 -7.9298834999e+00 1.8720145947e+00 2.0000000000e+05 5.7754894253e-01 9.8844375000e-01
|
||||
169 -2.1411697340e+00 4.7462866590e+00 -4.2222764718e+00 2.0811067378e+00 1.8364431535e+00 -7.9307342200e+00 1.8720145947e+00 2.0000000000e+05 5.6909270235e-01 9.8832125000e-01
|
||||
170 -2.1335862394e+00 4.7181182725e+00 -4.2354309883e+00 2.1018447489e+00 1.8322983422e+00 -7.9397439252e+00 1.8720145947e+00 2.0000000000e+05 5.6939236401e-01 9.8789750000e-01
|
||||
171 -2.1364802709e+00 4.7233471687e+00 -4.2242385905e+00 2.0877583196e+00 1.8394108110e+00 -7.9356639962e+00 1.8720145947e+00 2.0000000000e+05 5.6976613752e-01 9.8830250000e-01
|
||||
172 -2.1346428020e+00 4.7181228386e+00 -4.2180898438e+00 2.0834470418e+00 1.8336859154e+00 -7.9237903539e+00 1.8720145947e+00 2.0000000000e+05 5.7063707779e-01 9.8806000000e-01
|
||||
173 -2.1324009906e+00 4.7131424385e+00 -4.2120834679e+00 2.0796824773e+00 1.8365249218e+00 -7.9206229843e+00 1.8720145947e+00 2.0000000000e+05 5.7103203633e-01 9.8827375000e-01
|
||||
174 -2.1357583807e+00 4.7201272749e+00 -4.2340107406e+00 2.0982523600e+00 1.8312348348e+00 -7.9372601701e+00 1.8720145947e+00 2.0000000000e+05 5.7185471011e-01 9.8813500000e-01
|
||||
175 -2.1362426566e+00 4.7229477666e+00 -4.2325822808e+00 2.0963396242e+00 1.8242666463e+00 -7.9288635217e+00 1.8720145947e+00 2.0000000000e+05 5.6886414485e-01 9.8828250000e-01
|
||||
176 -2.1310554504e+00 4.7013058990e+00 -4.2254869898e+00 2.0944315394e+00 1.8410466758e+00 -7.9385482602e+00 1.8720145947e+00 2.0000000000e+05 5.6914957985e-01 9.8854250000e-01
|
||||
177 -2.1285116323e+00 4.6928245122e+00 -4.2397909254e+00 2.1112792931e+00 1.8347681454e+00 -7.9465736654e+00 1.8720145947e+00 2.0000000000e+05 5.6842063647e-01 9.8813625000e-01
|
||||
178 -2.1352921162e+00 4.7228085895e+00 -4.2375633547e+00 2.1022712385e+00 1.8338052577e+00 -7.9433832070e+00 1.8720145947e+00 2.0000000000e+05 5.6914273673e-01 9.8815375000e-01
|
||||
179 -2.1371340116e+00 4.7258501922e+00 -4.2476393802e+00 2.1105053686e+00 1.8399889150e+00 -7.9596428899e+00 1.8720145947e+00 2.0000000000e+05 5.6842554803e-01 9.8828375000e-01
|
||||
180 -2.1369986106e+00 4.7293703389e+00 -4.2119968838e+00 2.0749982733e+00 1.8416663824e+00 -7.9256778609e+00 1.8720145947e+00 2.0000000000e+05 5.7108933548e-01 9.8813875000e-01
|
||||
181 -2.1397140102e+00 4.7362144682e+00 -4.2262871129e+00 2.0865731027e+00 1.8385256526e+00 -7.9368273602e+00 1.8720145947e+00 2.0000000000e+05 5.6993799121e-01 9.8846375000e-01
|
||||
182 -2.1368660510e+00 4.7317120481e+00 -4.2327625462e+00 2.0958964953e+00 1.8375064764e+00 -7.9422836173e+00 1.8720145947e+00 2.0000000000e+05 5.6959559885e-01 9.8825875000e-01
|
||||
183 -2.1379404043e+00 4.7295279494e+00 -4.2383687170e+00 2.1004283127e+00 1.8352711596e+00 -7.9456544713e+00 1.8720145947e+00 2.0000000000e+05 5.6979657640e-01 9.8836750000e-01
|
||||
184 -2.1279630365e+00 4.6954442030e+00 -4.2477574345e+00 2.1197943980e+00 1.8515202650e+00 -7.9712922941e+00 1.8720145947e+00 2.0000000000e+05 5.6844223104e-01 9.8821500000e-01
|
||||
185 -2.1359911008e+00 4.7271815601e+00 -4.2446735617e+00 2.1086824609e+00 1.8468578500e+00 -7.9635460064e+00 1.8720145947e+00 2.0000000000e+05 5.7038829522e-01 9.8790875000e-01
|
||||
186 -2.1414479347e+00 4.7452991653e+00 -4.2344209163e+00 2.0929729817e+00 1.8303044526e+00 -7.9367399636e+00 1.8720145947e+00 2.0000000000e+05 5.6900947611e-01 9.8811750000e-01
|
||||
187 -2.1410880877e+00 4.7456113885e+00 -4.2563220349e+00 2.1152339472e+00 1.8396943788e+00 -7.9680310084e+00 1.8720145947e+00 2.0000000000e+05 5.6858403701e-01 9.8825375000e-01
|
||||
188 -2.1386758902e+00 4.7351691858e+00 -4.2113462459e+00 2.0726703557e+00 1.8321485731e+00 -7.9155094136e+00 1.8720145947e+00 2.0000000000e+05 5.6979199499e-01 9.8828875000e-01
|
||||
189 -2.1422991169e+00 4.7511428185e+00 -4.2279593506e+00 2.0856602337e+00 1.8313440873e+00 -7.9313180325e+00 1.8720145947e+00 2.0000000000e+05 5.6954781245e-01 9.8836500000e-01
|
||||
190 -2.1358819245e+00 4.7212302737e+00 -4.2299167101e+00 2.0940347856e+00 1.8297881897e+00 -7.9317194945e+00 1.8720145947e+00 2.0000000000e+05 5.7029061811e-01 9.8840500000e-01
|
||||
191 -2.1291659296e+00 4.6948466812e+00 -4.2187531888e+00 2.0895872592e+00 1.8353825913e+00 -7.9261503748e+00 1.8720145947e+00 2.0000000000e+05 5.6673824578e-01 9.8799250000e-01
|
||||
192 -2.1460722431e+00 4.7661254760e+00 -4.2066091349e+00 2.0605368918e+00 1.8379388472e+00 -7.9165625767e+00 1.8720145947e+00 2.0000000000e+05 5.6917457888e-01 9.8832875000e-01
|
||||
193 -2.1370332216e+00 4.7302254536e+00 -4.2162075206e+00 2.0791742990e+00 1.8424240101e+00 -7.9306461253e+00 1.8720145947e+00 2.0000000000e+05 5.6929834723e-01 9.8831250000e-01
|
||||
194 -2.1327026852e+00 4.7082849772e+00 -4.2290688971e+00 2.0963662119e+00 1.8415951183e+00 -7.9426786100e+00 1.8720145947e+00 2.0000000000e+05 5.6941070198e-01 9.8823500000e-01
|
||||
195 -2.1347774998e+00 4.7170085458e+00 -4.2377150201e+00 2.1029375202e+00 1.8363852542e+00 -7.9461148689e+00 1.8720145947e+00 2.0000000000e+05 5.6965193152e-01 9.8821625000e-01
|
||||
196 -2.1332892362e+00 4.7133268832e+00 -4.2215705035e+00 2.0882812673e+00 1.8528278331e+00 -7.9464129312e+00 1.8720145947e+00 2.0000000000e+05 5.6956664799e-01 9.8837750000e-01
|
||||
197 -2.1396100016e+00 4.7421153490e+00 -4.2170604710e+00 2.0774504694e+00 1.8450013900e+00 -7.9340764557e+00 1.8720145947e+00 2.0000000000e+05 5.6974155013e-01 9.8808125000e-01
|
||||
198 -2.1405919816e+00 4.7396269294e+00 -4.2273414021e+00 2.0867494205e+00 1.8388475125e+00 -7.9382035092e+00 1.8720145947e+00 2.0000000000e+05 5.6903076242e-01 9.8852875000e-01
|
||||
199 -2.1349724081e+00 4.7183300660e+00 -4.2484640468e+00 2.1134916388e+00 1.8424456118e+00 -7.9629242533e+00 1.8720145947e+00 2.0000000000e+05 5.7078825845e-01 9.8830875000e-01
|
||||
File diff suppressed because it is too large
Load Diff
|
|
@ -1,66 +0,0 @@
|
|||
<?xml version="1.0"?>
|
||||
<simulation>
|
||||
<project id="descent_ref" series="0"/>
|
||||
<!--random seed="7819"/-->
|
||||
<!-- input from gaussian converter -->
|
||||
<!--include href="h4_descent.structure.xml"/-->
|
||||
<include href="H4.ptcl.xml"/>
|
||||
|
||||
<!--include href="h4_descent.wf.xml"/-->
|
||||
<include href="H4.wfs.xml"/>
|
||||
|
||||
|
||||
<hamiltonian name="h0" type="generic" target="e">
|
||||
<pairpot name="ElecElec" type="coulomb" source="e" target="e" physical="true"/>
|
||||
<pairpot name="IonElec" type="coulomb" source="ion0" target="e"/>
|
||||
<pairpot name="IonIon" type="coulomb" source="ion0" target="ion0"/>
|
||||
</hamiltonian>
|
||||
|
||||
|
||||
|
||||
<loop max="50">
|
||||
<qmc method="linear" move="pbyp" checkpoint="-1" gpu="no">
|
||||
<parameter name="blocks">2000</parameter>
|
||||
<parameter name="steps">1</parameter>
|
||||
<parameter name="samples">20000</parameter>
|
||||
<parameter name="warmupsteps">1000</parameter>
|
||||
<parameter name="timestep">0.05</parameter>
|
||||
|
||||
<parameter name="MinMethod">descent</parameter>
|
||||
<estimator name="LocalEnergy" hdf5="no"/>
|
||||
<parameter name="usebuffer">yes</parameter>
|
||||
|
||||
<cost name="energy"> 1.00 </cost>
|
||||
<cost name="unreweightedvariance"> 0.00 </cost>
|
||||
<cost name="reweightedvariance"> 0.00 </cost>
|
||||
|
||||
<parameter name="flavor">RMSprop</parameter>
|
||||
|
||||
<parameter name="Ramp_eta">no</parameter>
|
||||
<parameter name="Ramp_num">30</parameter>
|
||||
|
||||
<parameter name="TJF_2Body_eta">.01</parameter>
|
||||
<parameter name="TJF_1Body_eta">.01</parameter>
|
||||
<parameter name="CI_eta">.2</parameter>
|
||||
|
||||
|
||||
|
||||
<parameter name="useDrift">no</parameter>
|
||||
<parameter name="nonlocalpp">no</parameter>
|
||||
<parameter name="use_nonlocalpp_deriv">no</parameter>
|
||||
<parameter name="max_relative_cost_change">10.0</parameter>
|
||||
<parameter name="max_param_change">3</parameter>
|
||||
<parameter name="shift_i">0.01</parameter>
|
||||
<parameter name="shift_s">1.00</parameter>
|
||||
</qmc>
|
||||
</loop>
|
||||
|
||||
<qmc method="vmc" move="pbyp" checkpoint="-1" gpu="no">
|
||||
<parameter name="blocks">200</parameter>
|
||||
<parameter name="steps">50000</parameter>
|
||||
<parameter name="warmupsteps">100</parameter>
|
||||
<parameter name="timestep">0.05</parameter>
|
||||
<parameter name="useDrift">yes</parameter>
|
||||
</qmc>
|
||||
|
||||
</simulation>
|
||||
|
|
@ -3,58 +3,64 @@
|
|||
<project id="H4-descent" series="0"/>
|
||||
<!--random seed="7819"/-->
|
||||
<!-- input from gaussian converter -->
|
||||
<include href="H4.ptcl.xml"/>
|
||||
<include href="H4.wfs.xml"/>
|
||||
<include href="h4_descent.structure.xml"/>
|
||||
|
||||
<include href="h4_descent.wf.xml"/>
|
||||
|
||||
|
||||
<hamiltonian name="h0" type="generic" target="e">
|
||||
<pairpot name="ElecElec" type="coulomb" source="e" target="e" physical="true"/>
|
||||
<pairpot name="IonElec" type="coulomb" source="ion0" target="e"/>
|
||||
<pairpot name="ElecElec" type="coulomb" source="e" target="e" physical="true"/>
|
||||
<pairpot name="IonElec" type="coulomb" source="ion0" target="e"/>
|
||||
<pairpot name="IonIon" type="coulomb" source="ion0" target="ion0"/>
|
||||
</hamiltonian>
|
||||
|
||||
|
||||
|
||||
<loop max="50">
|
||||
<qmc method="linear" move="pbyp" checkpoint="-1" gpu="no">
|
||||
<parameter name="blocks">2000</parameter>
|
||||
<parameter name="steps">1</parameter>
|
||||
<parameter name="samples">20000</parameter>
|
||||
<parameter name="warmupsteps">1000</parameter>
|
||||
<parameter name="timestep">0.05</parameter>
|
||||
<loop max="9">
|
||||
<qmc method="linear" move="pbyp" checkpoint="-1" gpu="no">
|
||||
<parameter name="blocks">2000</parameter>
|
||||
<parameter name="steps">1</parameter>
|
||||
<parameter name="samples">20000</parameter>
|
||||
<parameter name="warmupsteps">1000</parameter>
|
||||
<parameter name="timestep">0.05</parameter>
|
||||
|
||||
<parameter name="MinMethod">descent</parameter>
|
||||
<estimator name="LocalEnergy" hdf5="no"/>
|
||||
<parameter name="usebuffer">yes</parameter>
|
||||
<parameter name="MinMethod">descent</parameter>
|
||||
<estimator name="LocalEnergy" hdf5="no"/>
|
||||
<parameter name="usebuffer">yes</parameter>
|
||||
|
||||
<cost name="energy"> 1.00 </cost>
|
||||
<cost name="unreweightedvariance"> 0.00 </cost>
|
||||
<cost name="reweightedvariance"> 0.00 </cost>
|
||||
<cost name="energy"> 1.00 </cost>
|
||||
<cost name="unreweightedvariance"> 0.00 </cost>
|
||||
<cost name="reweightedvariance"> 0.00 </cost>
|
||||
|
||||
<parameter name="flavor">RMSprop</parameter>
|
||||
<parameter name="flavor">RMSprop</parameter>
|
||||
<parameter name="hybrid">no</parameter>
|
||||
|
||||
<parameter name="Ramp_eta">no</parameter>
|
||||
<parameter name="Ramp_num">30</parameter>
|
||||
|
||||
<parameter name="Ramp_eta">no</parameter>
|
||||
<parameter name="Ramp_num">30</parameter>
|
||||
|
||||
<parameter name="TJF_2Body_eta">.01</parameter>
|
||||
<parameter name="TJF_1Body_eta">.01</parameter>
|
||||
<parameter name="CI_eta">.2</parameter>
|
||||
<parameter name="TJF_2Body_eta">.001</parameter>
|
||||
<parameter name="TJF_1Body_eta">.001</parameter>
|
||||
<parameter name="CI_eta">.001</parameter>
|
||||
|
||||
<parameter name="useDrift">no</parameter>
|
||||
<parameter name="nonlocalpp">no</parameter>
|
||||
<parameter name="use_nonlocalpp_deriv">no</parameter>
|
||||
<parameter name="max_relative_cost_change">10.0</parameter>
|
||||
<parameter name="max_param_change">3</parameter>
|
||||
<parameter name="shift_i">0.01</parameter>
|
||||
<parameter name="shift_s">1.00</parameter>
|
||||
</qmc>
|
||||
</loop>
|
||||
|
||||
<qmc method="vmc" move="pbyp" checkpoint="-1" gpu="no">
|
||||
|
||||
<parameter name="useDrift">no</parameter>
|
||||
<parameter name="nonlocalpp">no</parameter>
|
||||
<parameter name="use_nonlocalpp_deriv">no</parameter>
|
||||
<parameter name="max_relative_cost_change">10.0</parameter>
|
||||
<parameter name="max_param_change">3</parameter>
|
||||
<parameter name="shift_i">0.01</parameter>
|
||||
<parameter name="shift_s">1.00</parameter>
|
||||
</qmc>
|
||||
</loop>
|
||||
|
||||
<qmc method="vmc" move="pbyp" checkpoint="-1" gpu="no">
|
||||
<parameter name="blocks">100</parameter>
|
||||
<parameter name="steps">500</parameter>
|
||||
<parameter name="warmupsteps">10</parameter>
|
||||
<parameter name="warmupsteps">100</parameter>
|
||||
<parameter name="timestep">0.05</parameter>
|
||||
<parameter name="useDrift">yes</parameter>
|
||||
</qmc>
|
||||
</qmc>
|
||||
|
||||
</simulation>
|
||||
|
|
|
|||
Loading…
Reference in New Issue