{ "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" [ [ 0.7607129 0.1029019 2.480933 ] [ 0.9158836 2.552597 0.2381701 ] [ 0.8989231 2.268448 2.632769 ] [ 2.109562 0.2713555 0.0459784 ] [ 2.969591 1.985029 0.1686784 ] [ 2.973458 2.362165 2.304699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.607129000000001e-11 1.029019e-11 2.480933e-10 ] [ 9.158836e-11 2.552597e-10 2.381701e-11 ] [ 8.989231e-11 2.268448e-10 2.632769e-10 ] [ 2.109562e-10 2.713555e-11 4.59784e-12 ] [ 2.969591e-10 1.985029e-10 1.686784e-11 ] [ 2.973458e-10 2.362165e-10 2.304699e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 45.9846564 -65.7784035 -100.5968978 ] [ -39.7547644 16.5650375 12.5625927 ] [ -33.8529785 73.3235516 8.2449834 ] [ -151.033673 -225.1749142 77.9056119 ] [ 144.1745354 197.2252608 1.1877633 ] [ 34.482224 3.8394678 0.6959466 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.36755413996011e-08 -1.053886202412489e-07 -1.611739977801669e-07 ] [ -6.369415408709213e-08 2.654011580517528e-08 2.012749232057275e-08 ] [ -5.423845069714505e-08 1.174772801275424e-07 1.32099196423641e-08 ] [ -2.419826198341522e-07 -3.607699831218859e-07 1.248185500152983e-07 ] [ 2.30993069932582e-07 3.159897018849427e-07 1.903006590304257e-09 ] [ 5.524661312598866e-08 6.15150554547441e-09 1.115029371845249e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 64.144017 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.027700444015978e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.7487758 -0.3043693 2.4477988 ] [ 0.6533935 2.6203828 0.115218 ] [ 0.614502 2.4556014 2.8576316 ] [ 1.6897308 -0.117801 -0.1899637 ] [ 3.5427145 2.0773 -0.031793 ] [ 3.3790139 2.8113825 2.6723361 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.487758e-11 -3.043693e-11 2.4477988e-10 ] [ 6.533935e-11 2.6203828e-10 1.15218e-11 ] [ 6.14502e-11 2.4556014e-10 2.8576316e-10 ] [ 1.6897308e-10 -1.17801e-11 -1.899637e-11 ] [ 3.542714500000001e-10 2.0773e-10 -3.1793e-12 ] [ 3.3790139e-10 2.8113825e-10 2.6723361e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.6e-06 -7.7e-06 1.44e-05 ] [ 1.95e-05 -6.1e-06 1.63e-05 ] [ -1.4e-06 1.03e-05 -5e-07 ] [ -9.8e-06 1.8e-06 -2.62e-05 ] [ 5.8e-06 -9.6e-06 -1.46e-05 ] [ -1.97e-05 1.12e-05 1.06e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.972189076479999e-15 -1.233675998016e-14 2.307134333952e-14 ] [ 3.12424441056e-14 -9.77327738688e-15 2.611547891904e-14 ] [ -2.24304726912e-15 1.650241919424e-14 -8.010883104e-16 ] [ -1.570133088384e-14 2.88391791744e-15 -4.197702746496e-14 ] [ 9.292624400640001e-15 -1.538089555968e-14 -2.339177866368e-14 ] [ -3.156287942976e-14 1.794437815296e-14 1.698307218048e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.691321 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.514026765566808e-18 } }