{ "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" [ [ 2.648062 2.256008 1.840542 ] [ 2.082623 2.792532 4.589039 ] [ 1.893054 0.6019814 4.219017 ] [ 3.79314 0.2675402 2.698761 ] [ 5.137376 2.400602 1.294264 ] [ 4.215429 1.396012 4.868853 ] [ 4.085322 3.344134 3.585876 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.648062e-10 2.256008e-10 1.840542e-10 ] [ 2.082623e-10 2.792532e-10 4.589039e-10 ] [ 1.893054e-10 6.019814000000001e-11 4.219017e-10 ] [ 3.79314e-10 2.675402e-11 2.698761000000001e-10 ] [ 5.137376e-10 2.400602e-10 1.294264e-10 ] [ 4.215429000000001e-10 1.396012e-10 4.868853e-10 ] [ 4.085322e-10 3.344134e-10 3.585876e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3136567 0.044034 -1.3289142 ] [ -4.3011183 4.056222 0.8303242 ] [ -2.4953763 -2.4145967 0.0232829 ] [ 0.26587 -3.3874006 -1.3607141 ] [ 1.1907067 0.7610438 -0.8034239 ] [ 5.2110604 -2.6574483 2.8507577 ] [ 1.4425143 3.5981458 -0.2113126 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.104710069837547e-09 7.055024590155599e-11 -2.129155279830802e-09 ] [ -6.891151240329802e-09 6.498784110716747e-09 1.330326031884743e-09 ] [ -3.998033600897375e-09 -3.868610413273507e-09 3.730331835175859e-11 ] [ 4.259707016815799e-10 -5.42721409131758e-09 -2.180104336574339e-09 ] [ 1.907722452687248e-09 1.219326593810569e-09 -1.287226999777152e-09 ] [ 8.349039211242693e-09 -4.257701572323021e-09 4.567417376135582e-09 ] [ 2.311162705670866e-09 5.764865126485237e-09 -3.385601101897883e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -13.593015 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.177841101861151e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1434877 2.3434986 1.6008486 ] [ 1.6779608 2.6199812 4.9595996 ] [ 1.5203604 0.6500655 4.4298187 ] [ 3.2032161 0.2430903 2.924094 ] [ 5.8026343 2.170723 1.452154 ] [ 5.0461006 1.5627131 3.9383025 ] [ 3.4612461 3.468738 3.7915346 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1434877e-10 2.3434986e-10 1.6008486e-10 ] [ 1.6779608e-10 2.6199812e-10 4.9595996e-10 ] [ 1.5203604e-10 6.500655e-11 4.429818700000001e-10 ] [ 3.2032161e-10 2.430903e-11 2.924094e-10 ] [ 5.8026343e-10 2.170723e-10 1.452154e-10 ] [ 5.0461006e-10 1.5627131e-10 3.9383025e-10 ] [ 3.4612461e-10 3.468738e-10 3.7915346e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.1e-06 -2.35e-05 -1.49e-05 ] [ -3.42e-05 -5.47e-05 -3.5e-05 ] [ -9.1e-06 8.75e-05 5.67e-05 ] [ 2e-07 1.8e-05 -1.87e-05 ] [ -2.76e-05 5.74e-05 9.5e-06 ] [ 4.81e-05 -4.28e-05 2.47e-05 ] [ 2.15e-05 -4.19e-05 -2.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.7623942974e-15 -3.765115089899999e-14 -2.38724318466e-14 ] [ -5.479444088279999e-14 -8.76390618798e-14 -5.607618218999999e-14 ] [ -1.45798073694e-14 1.40190455475e-13 9.08434151478e-14 ] [ 3.204353268e-16 2.8839179412e-14 -2.99607030558e-14 ] [ -4.42200750984e-14 9.196493879159998e-14 1.5220678023e-14 ] [ 7.706469609539999e-14 -6.857315993519999e-14 3.95737628598e-14 ] [ 3.4446797631e-14 -6.713120096459999e-14 -3.572853893819999e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.732399 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.001261197656497e-18 } }