{ "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" [ [ 1.697876 3.711698 1.143091 ] [ 3.423522 2.241155 2.183353 ] [ 3.951754 3.941629 0.5726112 ] [ 3.96365 5.193256 2.218192 ] [ 5.084028 3.36384 3.521791 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.697876e-10 3.711698e-10 1.143091e-10 ] [ 3.423522e-10 2.241155e-10 2.183353e-10 ] [ 3.951754000000001e-10 3.941629e-10 5.726112e-11 ] [ 3.96365e-10 5.193256e-10 2.218192e-10 ] [ 5.084028e-10 3.36384e-10 3.521791e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8578273 -0.4861396 -0.0295365 ] [ 0.416809 -0.5634199 0.8741623 ] [ 1.1205737 -2.3428255 -4.9515875 ] [ 0.7012436 3.9435877 4.1169945 ] [ -0.380799 -0.5512027 -0.0100328 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.976567490067308e-09 -7.788815079821063e-10 -4.7322690150141e-11 ] [ 6.678016406409059e-10 -9.026981989106165e-10 1.400562411383698e-09 ] [ 1.795356998814926e-09 -3.753620273639367e-09 -7.933317793706473e-09 ] [ 1.123516110662042e-09 6.318324067069801e-09 6.596152390206511e-09 ] [ -6.101072600505659e-10 -8.831240865377117e-10 -1.60743177335952e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -7.965944 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.27628493445525e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1473163 3.7739113 0.2954051 ] [ 4.2195357 2.2495508 2.320914 ] [ 3.1780589 4.0492625 1.3387342 ] [ 4.1673188 6.1243274 1.3999283 ] [ 5.4086002 2.2545261 4.2840566 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1473163e-10 3.7739113e-10 2.954051e-11 ] [ 4.2195357e-10 2.2495508e-10 2.320914e-10 ] [ 3.1780589e-10 4.0492625e-10 1.3387342e-10 ] [ 4.167318800000001e-10 6.1243274e-10 1.3999283e-10 ] [ 5.4086002e-10 2.2545261e-10 4.284056600000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.56e-05 -3.2e-06 -1.2e-05 ] [ 1.73e-05 1.4e-05 4.11e-05 ] [ 1.06e-05 -4e-06 5e-06 ] [ -1.5e-06 1.31e-05 -8.1e-06 ] [ -1.08e-05 -1.99e-05 -2.6e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.49939554904e-14 -5.1269652288e-15 -1.9226119608e-14 ] [ 2.77176557682e-14 2.243047287599999e-14 6.58494596574e-14 ] [ 1.69830723204e-14 -6.408706535999999e-15 8.010883169999999e-15 ] [ -2.403264951e-15 2.09885139054e-14 -1.29776307354e-14 ] [ -1.73035076472e-14 -3.18833150166e-14 -4.165659248399999e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.575945 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.694453196146913e-18 } }