{ "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" [ [ 0.2519361 0.630526 0.2961672 ] [ 1.040527 1.338339 0.9480581 ] [ 1.471162 2.964903 0.310665 ] [ 0.0960364 2.590998 1.829013 ] [ 2.039261 0.0625187 0.2196196 ] [ 2.19391 1.549757 2.906446 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.519361e-11 6.30526e-11 2.961672e-11 ] [ 1.040527e-10 1.338339e-10 9.480581e-11 ] [ 1.471162e-10 2.964903e-10 3.10665e-11 ] [ 9.60364e-12 2.590998e-10 1.829013e-10 ] [ 2.039261e-10 6.25187e-12 2.196196e-11 ] [ 2.19391e-10 1.549757e-10 2.906446e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -328.9015118 -259.0827787 -249.4136769 ] [ 294.9882264 240.729709 264.0718952 ] [ 9.0688498 34.2184465 -24.1171512 ] [ -31.5930018 33.8903809 28.4337487 ] [ 55.9083796 -45.9749761 -22.9340376 ] [ 0.5290579 -3.7807816 3.9592218 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.269583127517354e-07 -4.150963708850402e-07 -3.996047620369451e-07 ] [ 4.726232397493373e-07 3.856915116917874e-07 4.230898166997877e-07 ] [ 1.452989912710676e-08 5.482399498239559e-08 -3.863993581293866e-08 ] [ -5.061756886485232e-08 5.429837594798685e-08 4.55558874088424e-08 ] [ 8.957509870193166e-08 -7.366003184925877e-08 -3.674437886326814e-08 ] [ 8.476441984295442e-10 -6.057479887870817e-09 6.343372604521693e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 168.55143 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.700491605484078e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.5472356 0.1440582 0.4056482 ] [ 1.5218883 1.7937324 1.2184935 ] [ 2.353232 3.6639149 -0.1027148 ] [ -0.8919871 2.3125552 1.788656 ] [ 1.9511316 -0.3074522 -0.1312489 ] [ 2.7058032 1.5302333 3.331135 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.472356000000001e-11 1.440582e-11 4.056482e-11 ] [ 1.5218883e-10 1.7937324e-10 1.2184935e-10 ] [ 2.353232e-10 3.6639149e-10 -1.027148e-11 ] [ -8.919871e-11 2.3125552e-10 1.788656e-10 ] [ 1.9511316e-10 -3.074522e-11 -1.312489e-11 ] [ 2.7058032e-10 1.5302333e-10 3.331135e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.89e-05 -4.87e-05 2.2e-06 ] [ 7.39e-05 5.75e-05 -8.6e-06 ] [ 6.6e-06 5.13e-05 -1.7e-06 ] [ 2.29e-05 -2.3e-06 2.51e-05 ] [ -2.02e-05 -4.52e-05 3e-06 ] [ -6.43e-05 -1.25e-05 -2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.028113813312e-14 -7.802600143296e-14 3.52478856576e-15 ] [ 1.1840085227712e-13 9.212515569600001e-14 -1.377871893888e-14 ] [ 1.057436569728e-14 8.219166064704e-14 -2.72370025536e-15 ] [ 3.668984461632e-14 -3.68500622784e-15 4.021463318208e-14 ] [ -3.236396774016e-14 -7.241838326016e-14 4.8065298624e-15 ] [ -1.0301995671744e-13 -2.002720776e-14 -3.2043532416e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.344851 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.93916913842595e-18 } }