{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.009011 2.631584 2.068402 ] [ 2.205606 1.805457 4.240805 ] [ 0.8880067 3.587298 3.588265 ] [ 4.034619 2.466924 2.718393 ] [ 3.26703 4.599532 3.000235 ] [ 4.036538 3.227395 4.622039 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.009011e-10 2.631584e-10 2.068402e-10 ] [ 2.205606e-10 1.805457e-10 4.240805e-10 ] [ 8.880067e-11 3.587298e-10 3.588265e-10 ] [ 4.034619000000001e-10 2.466924e-10 2.718393e-10 ] [ 3.26703e-10 4.599532e-10 3.000235e-10 ] [ 4.036538e-10 3.227395e-10 4.622039e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -26.9439236 -121.7796168 -199.2974268 ] [ -2.9432673 -20.1714142 65.4171149 ] [ 151.7635361 176.0089431 45.6881326 ] [ 120.2168495 -129.9025084 -81.8851049 ] [ -239.8582901 98.2506304 87.6177518 ] [ -2.2349045 -2.406034 82.4595324 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.316892446454137e-08 -1.951124549269429e-07 -3.193096778045594e-07 ] [ -4.71563405682514e-09 -3.231816823971314e-08 1.048097720929673e-07 ] [ 2.431519894293568e-07 2.819974136865375e-07 7.320045789973033e-08 ] [ 1.926086256951322e-07 -2.081267619417556e-07 -1.311944006625355e-07 ] [ -3.842953447032841e-07 1.574148630057418e-07 1.403791135010171e-07 ] [ -3.580711739620713e-09 -3.854891423649907e-09 1.321147349733801e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 60.431365 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.682172016603139e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9921528 2.1575312 1.7656232 ] [ 1.8002623 1.6500308 4.6665215 ] [ 0.507546 4.0657625 3.7629201 ] [ 4.808474 2.4901405 2.1211392 ] [ 3.1146243 4.9714805 3.0202899 ] [ 4.2177514 2.9832445 4.9016451 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9921528e-10 2.1575312e-10 1.7656232e-10 ] [ 1.8002623e-10 1.6500308e-10 4.6665215e-10 ] [ 5.075460000000001e-11 4.0657625e-10 3.7629201e-10 ] [ 4.808474e-10 2.4901405e-10 2.1211392e-10 ] [ 3.1146243e-10 4.971480500000001e-10 3.0202899e-10 ] [ 4.2177514e-10 2.9832445e-10 4.9016451e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.28e-05 -2.28e-05 -1.7e-06 ] [ -3.05e-05 2.96e-05 -1.1e-05 ] [ 1.44e-05 -3.56e-05 1.18e-05 ] [ -4.1e-05 2.13e-05 -2.14e-05 ] [ 2.46e-05 1.58e-05 -1.18e-05 ] [ 9.7e-06 -8.3e-06 3.41e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.652962695424e-14 -3.652962695424e-14 -2.72370025536e-15 ] [ -4.88663869344e-14 4.742442797568e-14 -1.76239428288e-14 ] [ 2.307134333952e-14 -5.703748770048e-14 1.890568412544e-14 ] [ -6.56892414528e-14 3.412636202304e-14 -3.428657968511999e-14 ] [ 3.941354487168e-14 2.531439060864e-14 -1.890568412544e-14 ] [ 1.554111322176e-14 -1.329806595264e-14 5.463422276928e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.444463 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.474475753941063e-18 } }