{ "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" [ [ 1.498941 0.2917441 1.412179 ] [ 0.7321813 1.344758 2.47059 ] [ 0.7391833 1.573141 0.3619984 ] [ 0.011627 2.973124 1.6693 ] [ 2.701347 1.320916 0.403113 ] [ 2.713757 1.097636 2.168947 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.498941e-10 2.917441e-11 1.412179e-10 ] [ 7.321813e-11 1.344758e-10 2.47059e-10 ] [ 7.391833000000001e-11 1.573141e-10 3.619984e-11 ] [ 1.1627e-12 2.973124e-10 1.6693e-10 ] [ 2.701347e-10 1.320916e-10 4.03113e-11 ] [ 2.713757e-10 1.097636e-10 2.168947e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -325.105608 -472.0854589 183.0393406 ] [ -86.3563714 49.0831641 226.6292133 ] [ -58.0372974 64.3389743 -139.7226123 ] [ -5.3448945 23.2427419 -33.1963597 ] [ 357.8281975 278.3256533 -121.2804257 ] [ 117.0159738 57.0949253 -115.4691561 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.208766044285695e-07 -7.563642852692193e-07 2.932613521959682e-07 ] [ -1.383581593142018e-07 7.863989799590987e-08 3.631000271395564e-07 ] [ -9.298600102869663e-08 1.030824004297121e-07 -2.238603028241625e-07 ] [ -8.563465008542506e-09 3.723897767546857e-08 -5.31864314070073e-08 ] [ 5.733039722975051e-07 4.459268546861464e-07 -1.943126626172115e-07 ] [ 1.874802574825053e-07 9.147615448198243e-08 -1.850019823269257e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 277.47125 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.44557949694152e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.0538597 -0.3330162 1.2706175 ] [ 0.6312107 1.3824107 3.5117528 ] [ 0.47447 1.7472799 -0.5950596 ] [ -0.394299 3.178849 1.6378896 ] [ 3.2617783 1.4388305 -0.0876249 ] [ 3.3700169 1.1869651 2.748552 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0538597e-10 -3.330162e-11 1.2706175e-10 ] [ 6.312107000000001e-11 1.3824107e-10 3.5117528e-10 ] [ 4.7447e-11 1.7472799e-10 -5.950596e-11 ] [ -3.94299e-11 3.178849e-10 1.6378896e-10 ] [ 3.2617783e-10 1.4388305e-10 -8.76249e-12 ] [ 3.3700169e-10 1.1869651e-10 2.748552e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.1e-05 -1.12e-05 -1.11e-05 ] [ -0.0 8.82e-05 -2.1e-06 ] [ 2.4e-06 1.65e-05 -4.63e-05 ] [ -2.93e-05 -4.52e-05 2.93e-05 ] [ -2.2e-05 1.12e-05 -5.9e-06 ] [ 2.79e-05 -5.95e-05 3.61e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.36457090368e-14 -1.794437815296e-14 -1.778416049088e-14 ] [ 0.0 1.4131197795456e-13 -3.36457090368e-15 ] [ 3.84522388992e-15 2.64359142432e-14 -7.418077754303999e-14 ] [ -4.694377498944e-14 -7.241838326016e-14 4.694377498944e-14 ] [ -3.52478856576e-14 1.794437815296e-14 -9.45284206272e-15 ] [ 4.470072772032e-14 -9.532950893760001e-14 5.783857601088001e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.539142 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.489645001969136e-18 } }