{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.674789 2.922951 1.929928 ] [ 1.975006 0.6488867 2.865648 ] [ 2.721706 2.680777 4.242411 ] [ 4.506989 0.6613651 2.267837 ] [ 4.914488 1.931532 3.86875 ] [ 3.976236 4.774813 0.5862588 ] [ 4.03158 4.218687 2.874326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.674789e-10 2.922951e-10 1.929928e-10 ] [ 1.975006e-10 6.488867e-11 2.865648e-10 ] [ 2.721706e-10 2.680777e-10 4.242411e-10 ] [ 4.506989e-10 6.613651e-11 2.267837e-10 ] [ 4.914488e-10 1.931532e-10 3.86875e-10 ] [ 3.976236e-10 4.774813e-10 5.862588e-11 ] [ 4.03158e-10 4.218687e-10 2.874326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.2468784 -3.4548231 -5.4222428 ] [ 1.7105465 0.981201 -0.2064322 ] [ -1.0335479 -0.7781334 1.7353819 ] [ -2.2492421 -2.7965861 -2.774316 ] [ 1.4237294 3.4647923 2.5931392 ] [ -0.4847554 -0.7777346 0.1414447 ] [ 4.8801479 3.361284 3.9330253 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.804249339919305e-09 -5.535236845423445e-09 -8.687390718034735e-09 ] [ 2.740597633670481e-09 1.572057315457434e-09 -3.307408473452147e-10 ] [ -1.655926295499769e-09 -1.246707151614975e-09 2.780388331246524e-09 ] [ -3.603683136829091e-09 -4.480624904389186e-09 -4.444944270532342e-09 ] [ 2.281065977818839e-09 5.551209264723118e-09 4.154667034949452e-09 ] [ -7.766637750853235e-10 -1.246068203573337e-09 2.266193933431398e-10 ] [ 7.818858935844168e-09 5.385370685038055e-09 6.301401236590839e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.453562 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.956586585047031e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6674608 2.7228016 1.6688402 ] [ 1.9395564 0.6816706 2.8926144 ] [ 2.7228874 2.5636472 4.221272 ] [ 4.2144722 0.8375537 2.1493223 ] [ 5.1245311 2.2362421 3.8185623 ] [ 4.0368766 4.4774093 0.756518 ] [ 4.0950096 4.3196873 3.1280296 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6674608e-10 2.7228016e-10 1.6688402e-10 ] [ 1.9395564e-10 6.816706e-11 2.8926144e-10 ] [ 2.7228874e-10 2.5636472e-10 4.221272e-10 ] [ 4.214472200000001e-10 8.375536999999999e-11 2.1493223e-10 ] [ 5.1245311e-10 2.2362421e-10 3.8185623e-10 ] [ 4.0368766e-10 4.4774093e-10 7.565180000000001e-11 ] [ 4.0950096e-10 4.3196873e-10 3.1280296e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.99e-05 1.23e-05 4.6e-06 ] [ -3.6e-06 -6.1e-06 -1.83e-05 ] [ -3.55e-05 -2.4e-05 -5.1e-06 ] [ -4.2e-06 4.21e-05 1.02e-05 ] [ 3.63e-05 7.9e-06 1.05e-05 ] [ -1.43e-05 -3.54e-05 -3.61e-05 ] [ 4.12e-05 3.2e-06 3.43e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.18833150166e-14 1.97067725982e-14 7.370012516399999e-15 ] [ -5.767835882399999e-15 -9.773277467399999e-15 -2.93198324022e-14 ] [ -5.6877270507e-14 -3.8452239216e-14 -8.1711008334e-15 ] [ -6.729141862799999e-15 6.745163629139998e-14 1.63422016668e-14 ] [ 5.81590118142e-14 1.26571954086e-14 1.6822854657e-14 ] [ -2.29111258662e-14 -5.671705284359999e-14 -5.783857648740001e-14 ] [ 6.600967732079998e-14 5.1269652288e-15 5.49546585462e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.423544 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.432430161427089e-18 } }