{ "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" [ [ 0.6874791 0.1657934 2.219954 ] [ 0.5100092 2.362694 1.535272 ] [ 2.868635 0.820347 0.8272379 ] [ 1.615801 0.0071538 0.7495484 ] [ 2.741884 2.697599 0.8166341 ] [ 2.318736 2.919901 2.403388 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.874791e-11 1.657934e-11 2.219954e-10 ] [ 5.100092000000001e-11 2.362694e-10 1.535272e-10 ] [ 2.868635e-10 8.203470000000001e-11 8.272379e-11 ] [ 1.615801e-10 7.1538e-13 7.495484e-11 ] [ 2.741884e-10 2.697599e-10 8.166341000000001e-11 ] [ 2.318736e-10 2.919901e-10 2.403388e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.5215359 -0.6773706 16.7188681 ] [ -11.0756475 2.9143115 -0.9738689 ] [ 42.5907008 9.6452321 -0.0348319 ] [ -28.0500321 -28.4154349 -18.1918455 ] [ 8.8373734 10.288599 -24.7527829 ] [ -1.7808586 6.2446628 27.2344611 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.685735883388789e-08 -1.085267338937268e-09 2.678657959605892e-08 ] [ -1.774514348472197e-08 4.669241751028579e-09 -1.560309983304213e-09 ] [ 6.823782508524786e-08 1.545336537280969e-08 -5.580685583804352e-11 ] [ -4.494110564330953e-08 -4.552654546664439e-08 -2.914654954930569e-08 ] [ 1.415903305075981e-08 1.648415277858626e-08 -3.965833006211803e-08 ] [ -2.853250013870619e-09 1.000505274293947e-08 4.363441685450705e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 7.9951472 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.280963792369458e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0781259 0.3790501 2.7650063 ] [ 0.5836552 2.1500435 0.8787503 ] [ 3.0769768 0.8396894 1.1123592 ] [ 0.947338 -0.2950531 0.3796283 ] [ 2.8121203 3.2830138 0.5467619 ] [ 2.2443281 2.6167446 2.8695283 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0781259e-10 3.790501e-11 2.7650063e-10 ] [ 5.836552e-11 2.1500435e-10 8.787503e-11 ] [ 3.0769768e-10 8.396894e-11 1.1123592e-10 ] [ 9.47338e-11 -2.950531e-11 3.796283e-11 ] [ 2.8121203e-10 3.2830138e-10 5.467619e-11 ] [ 2.2443281e-10 2.6167446e-10 2.8695283e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.6e-05 -1.56e-05 -1.04e-05 ] [ 6.5e-06 -9.1e-06 -2e-07 ] [ 1e-06 -1.8e-06 -9.5e-06 ] [ -4.7e-06 -1.77e-05 1.21e-05 ] [ 2.8e-06 2.44e-05 7.5e-06 ] [ 2.03e-05 1.97e-05 5e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.16565921408e-14 -2.499395528448e-14 -1.666263685632e-14 ] [ 1.04141480352e-14 -1.457980724928e-14 -3.2043532416e-16 ] [ 1.6021766208e-15 -2.88391791744e-15 -1.52206778976e-14 ] [ -7.53023011776e-15 -2.835852618816e-14 1.938633711168e-14 ] [ 4.48609453824e-15 3.909310954752e-14 1.2016324656e-14 ] [ 3.252418540224e-14 3.156287942976e-14 8.010883104e-16 ] ] } "relaxed-potential-energy" { "source-value" -19.784895 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.169889621398282e-18 } }