{ "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" [ [ 0.1724043 0.1217148 2.355607 ] [ 0.0803944 1.628444 0.6781111 ] [ 0.0194903 2.198586 2.964695 ] [ 2.614645 0.684385 2.185781 ] [ 2.191382 2.601245 1.67848 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724043e-11 1.217148e-11 2.355607e-10 ] [ 8.03944e-12 1.628444e-10 6.781111e-11 ] [ 1.94903e-12 2.198586e-10 2.964695e-10 ] [ 2.614645e-10 6.84385e-11 2.185781e-10 ] [ 2.191382e-10 2.601245e-10 1.67848e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7179611 -9.3892131 2.1954441 ] [ -3.577137 2.0491899 -9.6567916 ] [ -4.0748758 7.1852908 7.38917 ] [ 5.8719587 -7.9856085 2.1869436 ] [ 2.4980151 8.1403409 -2.1147661 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.150300489063851e-09 -1.504317771652909e-08 3.517489209293297e-09 ] [ -5.731205270798649e-09 3.28316414935949e-09 -1.547188573345783e-08 ] [ -6.528670739423697e-09 1.151210493340933e-08 1.183875542111674e-08 ] [ 9.407914947443162e-09 -1.279435524156176e-08 3.503869906928187e-09 ] [ 4.002261391625374e-09 1.304226387532203e-08 -3.388228803880395e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.8076116 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.090699614900688e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1382412 0.0993736 2.3188731 ] [ 0.2477177 1.5065322 0.2591233 ] [ 0.1949121 2.3486166 3.4016284 ] [ 2.6043597 0.4854771 2.2568524 ] [ 1.8930852 2.7943753 1.6261969 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.382412e-11 9.937360000000001e-12 2.3188731e-10 ] [ 2.477177e-11 1.5065322e-10 2.591233e-11 ] [ 1.949121e-11 2.3486166e-10 3.4016284e-10 ] [ 2.6043597e-10 4.854771e-11 2.2568524e-10 ] [ 1.8930852e-10 2.7943753e-10 1.6261969e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.64e-05 3.39e-05 2.3e-06 ] [ 1.43e-05 7.6e-06 1.55e-05 ] [ 3.9e-06 -1.89e-05 -1.24e-05 ] [ -2.27e-05 1.6e-06 -5e-07 ] [ -2.19e-05 -2.43e-05 -4.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.229746278912e-14 5.431378744512e-14 3.68500622784e-15 ] [ 2.291112567744e-14 1.217654231808e-14 2.48337376224e-14 ] [ 6.24848882112e-15 -3.028113813312e-14 -1.986699009792e-14 ] [ -3.636940929216e-14 2.56348259328e-15 -8.010883104e-16 ] [ -3.508766799552e-14 -3.893289188544e-14 -7.69044777984e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.458486 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.835851837896411e-18 } }