{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.9885638e-10 1.2049246e-10 2.3441238e-10 ] [ 1.507356e-10 2.7795947e-10 3.3781054e-10 ] [ 1.3227849e-10 3.9370698e-10 1.2876076e-10 ] [ 3.3769168e-10 4.1743902e-10 4.0423896e-10 ] [ 4.9325965e-10 2.6528587e-10 3.0377256e-10 ] [ 3.2655556e-10 5.3876441e-10 1.9785885e-10 ] [ 3.785817300000001e-10 3.1280825e-10 6.923650000000001e-11 ] ] "source-value" [ [ 2.9885638 1.2049246 2.3441238 ] [ 1.507356 2.7795947 3.3781054 ] [ 1.3227849 3.9370698 1.2876076 ] [ 3.3769168 4.1743902 4.0423896 ] [ 4.9325965 2.6528587 3.0377256 ] [ 3.2655556 5.3876441 1.9785885 ] [ 3.7858173 3.1280825 0.692365 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 4.76951958245952e-12 -9.3454962291264e-12 3.05727342781056e-12 ] [ 1.22390272062912e-12 1.06897224139776e-12 2.12288402256e-13 ] [ -2.78442274928832e-12 6.673706496280319e-12 1.40446802579328e-12 ] [ -2.87334355174272e-12 -1.52959801987776e-12 -9.8966449866816e-13 ] [ 3.00520268763456e-12 -6.562355221134721e-12 6.161811065934721e-12 ] [ -3.48889980945408e-12 1.123798725361536e-11 -2.59889069659968e-12 ] [ 1.4804111976192e-13 -1.54337673881664e-12 -7.247125508864641e-12 ] ] "source-value" [ [ 0.0029769 -0.005833 0.0019082 ] [ 0.0007639 0.0006672 0.0001325 ] [ -0.0017379 0.0041654 0.0008766 ] [ -0.0017934 -0.0009547 -0.0006177 ] [ 0.0018757 -0.0040959 0.0038459 ] [ -0.0021776 0.0070142 -0.0016221 ] [ 9.24e-05 -0.0009633 -0.0045233 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.846368825501945e-18 "source-value" -17.765637 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.99038401601984e-12 -2.500156882778204e-09 -2.404785076377815e-09 ] [ -7.393084600107831e-09 -1.369047729909516e-08 8.928880159590167e-09 ] [ -1.736142667013491e-08 4.01297017994114e-10 -7.581736090677168e-09 ] [ 2.268861058181343e-09 1.257691295755197e-08 1.394478598758488e-08 ] [ 5.4512965236088e-09 -1.054750680840891e-09 6.902790516052167e-10 ] [ 9.869526064544952e-09 1.193388545906505e-08 -2.379967841174609e-09 ] [ 7.162837239891621e-09 -7.666710571896877e-09 -1.119745603033301e-08 ] ] "source-value" [ [ 0.0012423 -1.5604752 -1.5009488 ] [ -4.6144005 -8.5449239 5.5729687 ] [ -10.8361503 0.2504699 -4.7321475 ] [ 1.4161117 7.8498917 8.7036509 ] [ 3.4024317 -0.6583236 0.4308383 ] [ 6.1600737 7.4485455 -1.4854591 ] [ 4.4706914 -4.7851844 -6.9889024 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.442494742603762e-18 "source-value" -9.0033441 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.845445e-10 9.973996000000001e-11 1.833851e-10 ] [ 2.258239e-10 2.496991e-10 3.58031e-10 ] [ 1.78294e-10 4.270758e-10 1.69672e-10 ] [ 2.678494e-10 4.477221e-10 3.72616e-10 ] [ 4.64173e-10 2.41566e-10 3.489752e-10 ] [ 3.528967e-10 5.475060000000001e-10 1.628646e-10 ] [ 3.443776e-10 3.131475e-10 8.054665e-11 ] ] "source-value" [ [ 2.845445 0.9973996 1.833851 ] [ 2.258239 2.496991 3.58031 ] [ 1.78294 4.270758 1.69672 ] [ 2.678494 4.477221 3.72616 ] [ 4.64173 2.41566 3.489752 ] [ 3.528967 5.47506 1.628646 ] [ 3.443776 3.131475 0.8054665 ] ] } "instance-id" 1 }