{ "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" [ [ 2.327038 2.33879 1.333944 ] [ 3.095823 1.457233 3.921802 ] [ 1.16952 4.791902 2.053879 ] [ 1.997895 3.950607 4.032131 ] [ 4.742513 1.791132 2.167365 ] [ 3.563011 4.139404 2.001972 ] [ 4.473125 3.165685 4.251983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.327038e-10 2.33879e-10 1.333944e-10 ] [ 3.095823e-10 1.457233e-10 3.921802e-10 ] [ 1.16952e-10 4.791902e-10 2.053879e-10 ] [ 1.997895e-10 3.950607e-10 4.032131e-10 ] [ 4.742513e-10 1.791132e-10 2.167365e-10 ] [ 3.563011e-10 4.139404e-10 2.001972e-10 ] [ 4.473124999999999e-10 3.165685e-10 4.251983e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3237917 -0.2399593 2.5187344 ] [ -2.0948992 0.4899958 -3.2366143 ] [ 1.5320482 -2.4212995 -1.0045227 ] [ 2.2978153 -1.4391432 0.4227828 ] [ -2.6121331 1.7288462 1.1362458 ] [ 0.544344 0.1540072 1.68762 ] [ 0.0090331 1.7275528 -1.524246 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.187714917490873e-10 -3.844571804035334e-10 4.035457369684715e-09 ] [ -3.356398521172623e-09 7.850598150501927e-10 -5.185627762006957e-09 ] [ 2.454611807978723e-09 -3.87934945085473e-09 -1.609422785002892e-09 ] [ 3.681505952576538e-09 -2.305761589023299e-09 6.773727178363622e-10 ] [ -4.185098583237828e-09 2.769916962598921e-09 1.820466456242193e-09 ] [ 8.721352304727553e-10 2.467467352748698e-10 2.703865308794496e-09 ] [ 1.447262163334848e-11 2.767844707357578e-09 -2.442111305547917e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -27.680068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.434835781175421e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3801416 2.3072053 1.4100444 ] [ 2.700518 1.6635676 3.6741538 ] [ 1.2911722 4.2536123 2.0563343 ] [ 2.2822244 3.9560875 4.1351159 ] [ 4.5502917 1.9967903 2.185483 ] [ 3.6854188 4.2628422 2.136785 ] [ 4.4791584 3.1946476 4.1651596 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3801416e-10 2.3072053e-10 1.4100444e-10 ] [ 2.700518e-10 1.6635676e-10 3.6741538e-10 ] [ 1.2911722e-10 4.253612300000001e-10 2.0563343e-10 ] [ 2.2822244e-10 3.956087500000001e-10 4.1351159e-10 ] [ 4.5502917e-10 1.9967903e-10 2.185483e-10 ] [ 3.6854188e-10 4.2628422e-10 2.136785e-10 ] [ 4.4791584e-10 3.1946476e-10 4.1651596e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.62e-05 8.06e-05 -1.16e-05 ] [ -4.4e-06 -8e-06 1.77e-05 ] [ -4.67e-05 -1.81e-05 -6.3e-06 ] [ -4.54e-05 4.14e-05 -1.37e-05 ] [ 7.68e-05 -2.42e-05 1.41e-05 ] [ -1.69e-05 -3.25e-05 -1.56e-05 ] [ 6.28e-05 -3.91e-05 1.54e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.197702746496e-14 1.2913543563648e-13 -1.858524880128e-14 ] [ -7.04957713152e-15 -1.28174129664e-14 2.835852618816e-14 ] [ -7.482164819136e-14 -2.899939683648e-14 -1.009371271104e-14 ] [ -7.273881858432e-14 6.633011210111999e-14 -2.194981970496e-14 ] [ 1.2304716447744e-13 -3.877267422336e-14 2.259069035328e-14 ] [ -2.707678489152e-14 -5.207074017599999e-14 -2.499395528448e-14 ] [ 1.0061669178624e-13 -6.264510587328001e-14 2.467351996032e-14 ] ] } "relaxed-potential-energy" { "source-value" -30.380528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.867497168915979e-18 } }