{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.246807 1.041122 2.124463 ] [ 1.267764 1.326115 3.99765 ] [ 2.011294 2.700157 5.439591 ] [ 2.31677 3.176049 2.822929 ] [ 4.533635 0.1687206 2.857812 ] [ 4.258439 2.493804 2.204153 ] [ 4.092776 1.731475 4.602458 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.246807e-10 1.041122e-10 2.124463e-10 ] [ 1.267764e-10 1.326115e-10 3.99765e-10 ] [ 2.011294e-10 2.700157e-10 5.439591000000001e-10 ] [ 2.31677e-10 3.176049e-10 2.822929e-10 ] [ 4.533635000000001e-10 1.687206e-11 2.857812e-10 ] [ 4.258439e-10 2.493804e-10 2.204153e-10 ] [ 4.092776e-10 1.731475e-10 4.602458e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 15.9815096 -22.5428289 -39.9959248 ] [ -42.6302409 -32.4757977 8.1223511 ] [ 16.9512823 30.8984769 31.7344404 ] [ -32.1866615 32.5048536 10.7764298 ] [ 0.2003812 -9.4665919 -5.7742376 ] [ 40.2194876 -3.7520528 -13.9186806 ] [ 1.4642417 4.8339407 9.0556218 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.560520104621076e-08 -3.611759343027458e-08 -6.408053564183491e-08 ] [ -6.830117530905195e-08 -5.203196381677041e-08 1.301344103834916e-08 ] [ 2.715894819364085e-08 4.950481730750886e-08 5.0844178483051e-08 ] [ -5.156871655690346e-08 5.207851650044671e-08 1.726574388125242e-08 ] [ 3.21046073887849e-10 -1.516715222083465e-08 -9.251348485664301e-09 ] [ 6.44387227332755e-08 -6.011451276167178e-09 -2.230018464970251e-08 ] [ 2.345973818940448e-09 7.744826775873587e-09 1.450870553476681e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.0298037 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.649927412153337e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.291877 0.8738075 1.8720986 ] [ 0.6823827 1.2134691 3.8899982 ] [ 2.3093341 2.6358488 5.3497438 ] [ 1.9361475 3.418712 2.8590389 ] [ 4.4663827 -0.009232 2.9988291 ] [ 4.3682521 2.6328453 2.2862861 ] [ 4.6731089 1.8719919 4.7930614 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.291877e-10 8.738074999999999e-11 1.8720986e-10 ] [ 6.823827e-11 1.2134691e-10 3.8899982e-10 ] [ 2.3093341e-10 2.6358488e-10 5.3497438e-10 ] [ 1.9361475e-10 3.418712000000001e-10 2.8590389e-10 ] [ 4.4663827e-10 -9.232000000000001e-13 2.9988291e-10 ] [ 4.3682521e-10 2.6328453e-10 2.2862861e-10 ] [ 4.6731089e-10 1.8719919e-10 4.7930614e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.52e-05 1.64e-05 -3.59e-05 ] [ -2.93e-05 6.6e-06 5.2e-06 ] [ 1.27e-05 -1.85e-05 -2.3e-06 ] [ 1.77e-05 -1.93e-05 -1.51e-05 ] [ 2.53e-05 2.4e-05 2.81e-05 ] [ -1.81e-05 -1.36e-05 1.26e-05 ] [ 2.68e-05 4.3e-06 7.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.639661705216e-14 2.627569658112e-14 -5.751814068672e-14 ] [ -4.694377498944e-14 1.057436569728e-14 8.33131842816e-15 ] [ 2.034764308416e-14 -2.96402674848e-14 -3.68500622784e-15 ] [ 2.835852618816e-14 -3.092200878144e-14 -2.419286697408e-14 ] [ 4.053506850624e-14 3.84522388992e-14 4.502116304448e-14 ] [ -2.899939683648e-14 -2.178960204288e-14 2.018742542208e-14 ] [ 4.293833343744e-14 6.889359469440001e-15 1.185610699392e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.606916 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.942462552518945e-18 } }