/usr/share/cp2k/DFTB/scc/sh.spl is in cp2k-data 2.6.2-3.
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7*0.0 -5.829917241516e-04 1.248563549858e-04 -1.718155364743e-05 7*0.0 6.229497363282e-04 -1.299803281381e-04 -1.517631680942e-05
7*0.0 -5.649300838809e-04 1.206543194261e-04 -1.545530154797e-05 7*0.0 6.081306012046e-04 -1.252422844789e-04 -1.674357033306e-05
7*0.0 -5.474000477408e-04 1.165803937748e-04 -1.378542529442e-05 7*0.0 5.937271946989e-04 -1.205828270298e-04 -1.826557718200e-05
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7*0.0 -4.109783460012e-04 8.497298984269e-05 -1.029689374036e-06 7*0.0 4.805152839584e-04 -8.190596981182e-05 -3.005341598929e-05
7*0.0 -3.979369303823e-04 8.195495020553e-05 1.606575070630e-07 7*0.0 4.695305850081e-04 -7.794417808036e-05 -3.116365615665e-05
7*0.0 -3.852741844470e-04 7.902116803327e-05 1.310499178510e-06 7*0.0 4.588233468690e-04 -7.404503222088e-05 -3.223631877557e-05
7*0.0 -3.729826616642e-04 7.617105887177e-05 2.420607129608e-06 7*0.0 4.483834320821e-04 -7.020750089581e-05 -3.327198663289e-05
7*0.0 -3.610514562317e-04 7.340164554568e-05 3.492026447358e-06 7*0.0 4.382010623372e-04 -6.643060828238e-05 -3.427122770382e-05
7*0.0 -3.494723008335e-04 7.071041509097e-05 4.525759834160e-06 7*0.0 4.282668085124e-04 -6.271343120678e-05 -3.523459598431e-05
7*0.0 -3.382367000151e-04 6.809488898225e-05 5.522767084764e-06 7*0.0 4.185715809119e-04 -5.905509638168e-05 -3.616263228485e-05
7*0.0 -3.273364829824e-04 6.555267195665e-05 6.483976673204e-06 7*0.0 4.091066196979e-04 -5.545477774447e-05 -3.705586498706e-05
7*0.0 -3.167636971885e-04 6.308125944585e-05 7.410310738195e-06 7*0.0 3.998634855181e-04 -5.191169389347e-05 -3.791481076430e-05
7*0.0 -3.065139792175e-04 6.069878736214e-05 8.300123168832e-06 7*0.0 3.908340503228e-04 -4.842510561957e-05 -3.873997526753e-05
7*0.0 -2.965696480357e-04 5.834256471102e-05 9.161732398793e-06 7*0.0 3.820104883726e-04 -4.499431353071e-05 -3.953185377766e-05
7*0.0 -2.869341730258e-04 5.607252891801e-05 9.988311551508e-06 7*0.0 3.733852674334e-04 -4.161865576666e-05 -4.029093182561e-05
7*0.0 -2.775952731580e-04 5.386426269707e-05 1.078339265563e-05 7*0.0 3.649511401562e-04 -3.829750580168e-05 -4.101768578117e-05
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7*0.0 -2.597807182792e-04 4.962808582908e-05 1.228183393793e-05 7*0.0 3.486285511780e-04 -3.181638724983e-05 -4.237608441241e-05
7*0.0 -2.512882577844e-04 4.759488595217e-05 1.298680265011e-05 7*0.0 3.407269441754e-04 -2.865532368947e-05 -4.300864090745e-05
7*0.0 -2.431189999308e-04 4.565173744083e-05 1.365981705874e-05 7*0.0 3.329901242535e-04 -2.554657416333e-05 -4.361069792583e-05
7*0.0 -2.351098300997e-04 4.369694642197e-05 1.431117852301e-05 7*0.0 3.254121455208e-04 -2.248965876552e-05 -4.418269385019e-05
7*0.0 -2.274025237905e-04 4.182422721054e-05 1.493234795413e-05 7*0.0 3.179872990184e-04 -1.948412145294e-05 -4.472506084117e-05
7*0.0 -2.199442243498e-04 4.000274668086e-05 1.552680004195e-05 7*0.0 3.107101053350e-04 -1.652952839761e-05 -4.523822523782e-05
7*0.0 -2.127266310561e-04 3.822996876856e-05 1.609526652770e-05 7*0.0 3.035753073893e-04 -1.362546640878e-05 -4.572260793491e-05
7*0.0 -2.057433443363e-04 3.650423135097e-05 1.663839487173e-05 7*0.0 2.965778633773e-04 -1.077154142265e-05 -4.617862473814e-05
7*0.0 -1.989875945089e-04 3.482404969376e-05 1.715678869584e-05 7*0.0 2.897129398823e-04 -7.967377057870e-06 -4.660668669809e-05
7*0.0 -1.924529595854e-04 3.318790962817e-05 1.765105308110e-05 7*0.0 2.829759051454e-04 -5.212613234662e-06 -4.700720042379e-05
7*0.0 -1.861062654397e-04 3.160491785949e-05 1.811961292678e-05 7*0.0 2.763623224942e-04 -2.506904855689e-06 -4.738056837662e-05
7*0.0 -1.800230058366e-04 3.004390144064e-05 1.856944877414e-05 7*0.0 2.698679439270e-04 1.500794531615e-07 -4.772718914551e-05
7*0.0 -1.741079874823e-04 2.852335929549e-05 1.899568158197e-05 7*0.0 2.634887038509e-04 2.758658544022e-06 -4.804745770400e-05
7*0.0 -1.683931741321e-04 2.705911615508e-05 1.939759516192e-05 7*0.0 2.572207129704e-04 5.319139892066e-06 -4.834176565013e-05
7*0.0 -1.628669590876e-04 2.562363760808e-05 1.977939178028e-05 7*0.0 2.510602523252e-04 7.831820686097e-06 -4.861050142972e-05
7*0.0 -1.575329566055e-04 2.423274997579e-05 2.013939074241e-05 7*0.0 2.450037674743e-04 1.029698886645e-05 -4.885405054379e-05
7*0.0 -1.523611089932e-04 2.284994287206e-05 2.048244592717e-05 7*0.0 2.390478628246e-04 1.271492411186e-05 -4.907279574087e-05
7*0.0 -1.473733676286e-04 2.153586354906e-05 2.080071271935e-05 7*0.0 2.331892961003e-04 1.508589877699e-05 -4.926711719479e-05
7*0.0 -1.425501220928e-04 2.024025699120e-05 2.110165594404e-05 7*0.0 2.274249729528e-04 1.741017878222e-05 -4.943739266853e-05
7*0.0 -1.378889225512e-04 1.897774061160e-05 2.138342696006e-05 7*0.0 2.217519417074e-04 1.968802445726e-05 -4.958399766500e-05
7*0.0 -1.333852395547e-04 1.774697764196e-05 2.164654585113e-05 7*0.0 2.161673882446e-04 2.191969134011e-05 -4.970730556498e-05
7*0.0 -1.290320821205e-04 1.654646847249e-05 2.189146037056e-05 7*0.0 2.106686310142e-04 2.410543093298e-05 -4.980768775319e-05
7*0.0 -1.248258554384e-04 1.537569945710e-05 2.211857661657e-05 7*0.0 2.052531161800e-04 2.624549141646e-05 -4.988551373272e-05
7*0.0 -1.207619473597e-04 1.423386676913e-05 2.232829949605e-05 7*0.0 1.999184128917e-04 2.834011832356e-05 -4.994115122862e-05
7*0.0 -1.168354892388e-04 1.312010178077e-05 2.252102550250e-05 7*0.0 1.946622086833e-04 3.038955517481e-05 -4.997496628101e-05
7*0.0 -1.130419246924e-04 1.203361976279e-05 2.269714006945e-05 7*0.0 1.894823049944e-04 3.239404407607e-05 -4.998732332829e-05
7*0.0 -1.093768581093e-04 1.097367663105e-05 2.285701914174e-05 7*0.0 1.843766128133e-04 3.435382628003e-05 -4.997858528096e-05
7*0.0 -1.058360186069e-04 9.939558309766e-06 2.300102980052e-05 7*0.0 1.793431484388e-04 3.626914271299e-05 -4.994911358649e-05
7*0.0 -1.024152497537e-04 8.930576081833e-06 2.312953087198e-05 7*0.0 1.743800293588e-04 3.814023446804e-05 -4.989926828566e-05
7*0.0 -9.911045731705e-05 7.946042762166e-06 2.324287494528e-05 7*0.0 1.694854702436e-04 3.996734326588e-05 -4.982940806097e-05
7*0.0 -9.591693239525e-05 6.984963639423e-06 2.334143170531e-05 7*0.0 1.646577790517e-04 4.175071188455e-05 -4.973989027735e-05
7*0.0 -9.280661527950e-05 6.035824802642e-06 2.342634206109e-05 7*0.0 1.598953532460e-04 4.349058455914e-05 -4.963107101573e-05
7*0.0 -8.985358465644e-05 5.133029287239e-06 2.349534871766e-05 7*0.0 1.551966761179e-04 4.518720735266e-05 -4.950330509979e-05
7*0.0 -8.697606945487e-05 4.241624635598e-06 2.355126131544e-05 7*0.0 1.505603132175e-04 4.684082849928e-05 -4.935694611633e-05
7*0.0 -8.419461358446e-05 3.369256636543e-06 2.359396374716e-05 7*0.0 1.459849088878e-04 4.845169872080e-05 -4.919234642959e-05
7*0.0 -8.150816957812e-05 2.519733485690e-06 2.362322824374e-05 7*0.0 1.414691829011e-04 5.002007151761e-05 -4.900985718992e-05
7*0.0 -7.891249761248e-05 1.690366122818e-06 2.363963349286e-05 7*0.0 1.370119271943e-04 5.154620343504e-05 -4.880982833707e-05
7*0.0 -7.640467776824e-05 8.811035168921e-07 2.364342377014e-05 7*0.0 1.326120027029e-04 5.303035430614e-05 -4.859260859854e-05
7*0.0 -7.398280399567e-05 9.216900243644e-08 2.363483143786e-05 7*0.0 1.282683362902e-04 5.447278747187e-05 -4.835854548319e-05
7*0.0 -7.164222507219e-05 -6.785956330845e-07 2.361432483603e-05 7*0.0 1.239799177703e-04 5.587376997954e-05 -4.810798527057e-05
7*0.0 -6.940328941729e-05 -1.436091346566e-06 2.358357372458e-05 7*0.0 1.197457970231e-04 5.723357276058e-05 -4.784127299607e-05
7*0.0 -6.719160011680e-05 -2.164303031439e-06 2.353820853992e-05 7*0.0 1.155650811984e-04 5.855247078839e-05 -4.755875243235e-05
7*0.0 -6.507697373733e-05 -2.880188260307e-06 2.348321268588e-05 7*0.0 1.114369320090e-04 5.983074321715e-05 -4.726076606727e-05
7*0.0 -6.304912545541e-05 -3.572339884772e-06 2.341685116271e-05 7*0.0 1.073605631088e-04 6.106867350251e-05 -4.694765507846e-05
7*0.0 -6.106043638699e-05 -4.257105194986e-06 2.334037503875e-05 7*0.0 1.033352375551e-04 6.226654950491e-05 -4.661975930505e-05
7*0.0 -5.915205406443e-05 -4.920374113629e-06 2.325321849434e-05 7*0.0 9.936026535344e-05 6.342466357624e-05 -4.627741721650e-05
Spline
21 3.61
1.328996967632858 1.585603771658841 -0.2393319290995536
1.6 1.7 0.3429553324035217 -0.7738580048288279 0.5142274708979628 0.003408892308028881
1.7 1.8 0.2707152155219267 -0.6709102438799946 0.5152501385903715 -0.01704446154029943
1.8 1.9 0.2087596480582906 -0.5683715500081292 0.5101368001282817 -0.1047880063068431
1.9 2 0.1569190730524537 -0.4694878301716783 0.4787003982362288 -0.1472445065925175
2 2.1 0.1146100495110556 -0.378165085722208 0.4345270462584735 -0.1778665298830286
2.1 2.2 0.08096094487153649 -0.2965956723670041 0.3811670872935649 -0.190978081635216
2.2 2.3 0.05492207042613649 -0.2260915973573475 0.323873662803 -0.1913876125364294
2.3 2.4 0.03536025970589537 -0.1670584931728406 0.2664573790420714 -0.18109435437865
2.4 2.5 0.02113788982465336 -0.1191998479957858 0.2121290727284764 -0.1628499693092572
2.5 2.6 0.01117634578305028 -0.08165953252936821 0.1632740819356991 -0.1392056169442093
2.6 2.7 0.004503927732526237 -0.05318088465055464 0.1215123968524363 -0.1127620366739392
2.7 2.8 0.000288201199321195 -0.03226126638028554 0.08768378585025453 -0.08612215132006312
2.8 2.9 -0.00214720973152487 -0.01730817374983656 0.06184714045423569 -0.06183057020576301
2.9 3 -0.003321386272171933 -0.006793662765162307 0.04329796939250677 -0.042662973216911
3 3.1 -0.003610435827980007 0.0005860419168317215 0.03049907742743346 -0.03052907148657724
3.1 3.2 -0.003277369933509077 0.005769985257721101 0.02134035598146028 -0.03057138059678793
3.2 3.3 -0.002517539228519151 0.009120915036109522 0.01216894180242389 -0.03586716708626412
3.3 3.4 -0.001519625473970228 0.01047868838400638 0.001408791676544695 -0.08452188921816806
3.4 3.5 -0.0005421906080223108 0.008224790042770267 -0.02394777508890574 -0.0465934874010634
3.5 3.6 -5.782842035404728e-06 0.002037430402957209 -0.03792582130922478 0.1812980148319316
3.6 3.61 0 -0.0001087934139297953 0.01646358314035475 1.588529893681461 -376.439817227754 16174.44103858556
|