{ "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" [ [ -100.3226608 -78.5993924 -68.6012652 ] [ 78.2591598 58.0195943 74.2406712 ] [ 11.7510608 28.0293688 -13.7132042 ] [ -17.322567 20.0663724 22.4344878 ] [ 31.49681 -26.2482683 -11.0067117 ] [ -3.8618028 -1.2676749 -3.3539779 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.607346216702086e-07 -1.259301089123652e-07 -1.099113432607406e-07 ] [ 1.253849961950112e-07 9.295763753576094e-08 1.189466677091399e-07 ] [ 1.882727488335934e-08 4.490799938714096e-08 -2.197097516549637e-08 ] [ -2.77538118596416e-08 3.214987272354638e-08 3.594401185278283e-08 ] [ 5.046345261177965e-08 -4.205436180674576e-08 -1.763469615762582e-08 ] [ -6.187290160299979e-09 -2.031039087554978e-09 -5.37366497805988e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 52.051604 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.339586300393976e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0887852 -0.4395016 0.5477601 ] [ 1.3473471 1.4675954 1.3940525 ] [ 1.7507627 3.7201748 0.3083327 ] [ -0.4230704 3.2790334 1.3912888 ] [ 2.0850904 0.0014642 -0.5351641 ] [ 2.4214879 1.1082755 3.4036989 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.87852e-12 -4.395016e-11 5.477601e-11 ] [ 1.3473471e-10 1.4675954e-10 1.3940525e-10 ] [ 1.7507627e-10 3.7201748e-10 3.083327000000001e-11 ] [ -4.230704e-11 3.2790334e-10 1.3912888e-10 ] [ 2.0850904e-10 1.4642e-13 -5.351641000000001e-11 ] [ 2.4214879e-10 1.1082755e-10 3.4036989e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.12e-05 -1.06e-05 2.79e-05 ] [ 4.05e-05 -7.74e-05 5.26e-05 ] [ 5e-07 7.1e-06 -1.71e-05 ] [ 1.32e-05 1.28e-05 8.3e-06 ] [ 1.97e-05 3.79e-05 -3.57e-05 ] [ -5.28e-05 3.02e-05 -3.61e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.396614436096001e-14 -1.698307218048e-14 4.470072772032e-14 ] [ 6.488815314240001e-14 -1.2400847044992e-13 8.427449025408001e-14 ] [ 8.010883104e-16 1.137545400768e-14 -2.739722021568e-14 ] [ 2.114873139456e-14 2.050786074624e-14 1.329806595264e-14 ] [ 3.156287942976e-14 6.072249392832e-14 -5.719770536256001e-14 ] [ -8.459492557824e-14 4.838573394816e-14 -5.783857601088001e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.967527 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.917409196819276e-18 } }