{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.137834 0.6178187 0.8180482 ] [ 0.8147489 0.2195668 2.521416 ] [ 0.6602072 2.742467 0.5700192 ] [ 2.747217 2.135327 0.0253318 ] [ 2.249122 2.278269 1.668886 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.137834e-10 6.178187000000001e-11 8.180482000000001e-11 ] [ 8.147489e-11 2.195668e-11 2.521416e-10 ] [ 6.602072e-11 2.742467e-10 5.700191999999999e-11 ] [ 2.747217e-10 2.135327e-10 2.53318e-12 ] [ 2.249122e-10 2.278269e-10 1.668886e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6571003 -7.2424359 -20.0067833 ] [ -6.0775709 -8.7509168 21.2133439 ] [ -15.3280691 9.7187394 -6.5891741 ] [ 15.1256161 -1.6716026 -29.9412231 ] [ 6.9371242 7.946216 35.3238367 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.05279074685439e-09 -1.160366157222276e-08 -3.20544007247614e-08 ] [ -9.73734208745835e-09 -1.402051442303805e-08 3.398752392558643e-08 ] [ -2.455827415635741e-08 1.557113717861518e-08 -1.055702078037798e-08 ] [ 2.423390869027421e-08 -2.678202627053648e-09 -4.797112804420104e-08 ] [ 1.111449830039594e-08 1.273124160391694e-08 5.659502578397166e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 8.4216696 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.349300225238812e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0390199 0.7684543 0.8853824 ] [ 0.3471264 -1.0532375 2.0981451 ] [ 0.3488742 3.0262026 1.1880785 ] [ 3.2821297 1.4971387 0.5647219 ] [ 2.591979 3.7548902 0.8673734 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0390199e-10 7.684543000000001e-11 8.853824e-11 ] [ 3.471264e-11 -1.0532375e-10 2.0981451e-10 ] [ 3.488742000000001e-11 3.0262026e-10 1.1880785e-10 ] [ 3.2821297e-10 1.4971387e-10 5.647219e-11 ] [ 2.591979e-10 3.7548902e-10 8.673734e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.12e-05 -1.82e-05 1.22e-05 ] [ 1.71e-05 3.16e-05 -8.8e-06 ] [ 8e-07 4e-06 -1.06e-05 ] [ 1.64e-05 -6.8e-06 -1.25e-05 ] [ -1.31e-05 -1.07e-05 1.97e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.39661446408e-14 -2.915961473879999e-14 1.95465549348e-14 ] [ 2.73972204414e-14 5.06287816344e-14 -1.40991543792e-14 ] [ 1.2817413072e-15 6.408706535999999e-15 -1.69830723204e-14 ] [ 2.62756967976e-14 -1.08948011112e-14 -2.0027207925e-14 ] [ -2.09885139054e-14 -1.71432899838e-14 3.15628796898e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.301703 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.81073244710077e-18 } }