{ "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" [ [ 1.999551 1.685791 2.486539 ] [ 2.806467 1.943327 4.558328 ] [ 1.52714 3.922099 3.002179 ] [ 4.336396 2.072479 2.061694 ] [ 5.046676 1.88237 4.081611 ] [ 3.556935 4.352885 1.849563 ] [ 3.300335 4.140991 4.307093 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.999551e-10 1.685791e-10 2.486539e-10 ] [ 2.806467e-10 1.943327e-10 4.558328e-10 ] [ 1.52714e-10 3.922099e-10 3.002179e-10 ] [ 4.336396e-10 2.072479e-10 2.061694e-10 ] [ 5.046676e-10 1.88237e-10 4.081611e-10 ] [ 3.556935e-10 4.352885e-10 1.849563e-10 ] [ 3.300335e-10 4.140991e-10 4.307093e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3529009 -1.4716451 -2.0802476 ] [ -0.0371087 -1.6252284 3.2815743 ] [ -4.4955452 0.5614122 -2.0113771 ] [ -0.6578703 0.4628258 -3.7257089 ] [ 2.4435047 -1.0244275 2.848806 ] [ 1.5364382 0.5560949 -1.1551022 ] [ 2.5634822 2.5409682 2.8420555 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.16758621009757e-09 -2.357835392760593e-09 -3.332924097654578e-09 ] [ -5.94546920581158e-11 -2.603902967393205e-09 5.257661666194906e-09 ] [ -7.202657476530855e-09 8.994815088825347e-10 -3.222581391782681e-09 ] [ -1.05402442286257e-09 7.415286823723571e-10 -5.969243744665842e-09 ] [ 3.914926135409179e-09 -1.641313803727035e-09 4.564290407999004e-09 ] [ 2.461645383625019e-09 8.909622550665664e-10 -1.850677754721995e-09 ] [ 4.107151282514914e-09 4.071079877777039e-09 4.553474914631186e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.686386 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.513236112110472e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1725525 1.8727937 2.782459 ] [ 3.1317893 1.9016804 5.0296958 ] [ 1.7987918 4.2869018 2.7239275 ] [ 4.3426948 2.0076315 1.6674024 ] [ 5.1739063 1.5480543 3.8531422 ] [ 3.6630879 4.2514765 1.2397745 ] [ 2.2906773 4.1314038 5.0506056 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1725525e-10 1.8727937e-10 2.782459e-10 ] [ 3.1317893e-10 1.9016804e-10 5.0296958e-10 ] [ 1.7987918e-10 4.2869018e-10 2.7239275e-10 ] [ 4.342694800000001e-10 2.0076315e-10 1.6674024e-10 ] [ 5.1739063e-10 1.5480543e-10 3.8531422e-10 ] [ 3.6630879e-10 4.2514765e-10 1.2397745e-10 ] [ 2.2906773e-10 4.1314038e-10 5.0506056e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.77e-05 -3.9e-06 1.03e-05 ] [ -2e-06 -9.8e-06 2.65e-05 ] [ -4.4e-06 1.69e-05 -1.15e-05 ] [ 5.9e-06 -2.73e-05 -1.74e-05 ] [ -2.69e-05 3.13e-05 -2.29e-05 ] [ 1.54e-05 3.3e-06 -9e-07 ] [ -5.8e-06 -1.04e-05 1.6e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.83585264218e-14 -6.248488872599999e-15 1.65024193302e-14 ] [ -3.204353268e-15 -1.57013310132e-14 4.2457680801e-14 ] [ -7.0495771896e-15 2.70767851146e-14 -1.8425031291e-14 ] [ 9.452842140600001e-15 -4.37394221082e-14 -2.78778734316e-14 ] [ -4.309855145459999e-14 5.014812864419999e-14 -3.66898449186e-14 ] [ 2.46735201636e-14 5.2871828922e-15 -1.4419589706e-15 ] [ -9.2926244772e-15 -1.66626369936e-14 2.5634826144e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.395357 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.947261115948834e-18 } }