{ "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" [ [ 2.290406 1.365127 2.478138 ] [ 1.892594 2.812526 4.141756 ] [ 2.634032 3.625436 1.937955 ] [ 4.696761 2.293416 2.137678 ] [ 4.185297 2.165547 4.431715 ] [ 4.453239 5.273552 2.545611 ] [ 3.870361 4.380343 4.592008 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.290406e-10 1.365127e-10 2.478138e-10 ] [ 1.892594e-10 2.812526e-10 4.141756e-10 ] [ 2.634032e-10 3.625436e-10 1.937955e-10 ] [ 4.696761000000001e-10 2.293416e-10 2.137678e-10 ] [ 4.185297000000001e-10 2.165547e-10 4.431715e-10 ] [ 4.453239e-10 5.273551999999999e-10 2.545611e-10 ] [ 3.870361e-10 4.380343e-10 4.592008e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.911203 -2.7534095 2.2741172 ] [ -3.4128705 1.1466246 2.8433961 ] [ 1.2943454 4.7775543 -0.7645134 ] [ 1.75053 0.2466402 -1.0516066 ] [ -1.4190253 -4.3883988 -2.048458 ] [ -0.9413633 -1.2920497 -0.7024814 ] [ -0.1828193 2.2630389 -0.5504539 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.664261385002823e-09 -4.411448328388618e-09 3.643537410799158e-09 ] [ -5.468021324918006e-09 1.837095126954152e-09 4.555622755093899e-09 ] [ 2.073769939120025e-09 7.65448580406251e-09 -1.224885495768319e-09 ] [ 2.804658240009024e-09 3.951611621894361e-10 -1.684859508798977e-09 ] [ -2.273529159983706e-09 -7.030989960106776e-09 -3.281991516290726e-09 ] [ -1.508230270939137e-09 -2.070091822251654e-09 -1.125499275626853e-09 ] [ -2.929088082910214e-10 3.625788017540949e-09 -8.819243694081811e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -22.062579 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.534814826835304e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6355852 1.3124189 2.5905693 ] [ 1.7887392 2.7332305 4.3769912 ] [ 2.5388848 3.8430122 2.1909985 ] [ 4.5827889 2.4046198 1.6196845 ] [ 4.3247355 2.4186856 4.1703938 ] [ 4.9393858 4.5004422 2.8060568 ] [ 3.2125705 4.7035379 4.5101669 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6355852e-10 1.3124189e-10 2.5905693e-10 ] [ 1.7887392e-10 2.7332305e-10 4.3769912e-10 ] [ 2.5388848e-10 3.8430122e-10 2.1909985e-10 ] [ 4.5827889e-10 2.4046198e-10 1.6196845e-10 ] [ 4.3247355e-10 2.4186856e-10 4.1703938e-10 ] [ 4.9393858e-10 4.5004422e-10 2.8060568e-10 ] [ 3.2125705e-10 4.7035379e-10 4.5101669e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.13e-05 1.5e-05 2.81e-05 ] [ -1.1e-06 -1.98e-05 -1.33e-05 ] [ 1.42e-05 -7e-07 -4.24e-05 ] [ 2.3e-06 -1.38e-05 -2.93e-05 ] [ 4.41e-05 1.47e-05 1.24e-05 ] [ -1.31e-05 5.2e-06 2.44e-05 ] [ -5.2e-06 -7e-07 2.01e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.616989443904001e-14 2.4032649312e-14 4.502116304448e-14 ] [ -1.76239428288e-15 -3.172309709184e-14 -2.130894905664e-14 ] [ 2.275090801536e-14 -1.12152363456e-15 -6.793228872192001e-14 ] [ 3.68500622784e-15 -2.211003736704e-14 -4.694377498944e-14 ] [ 7.065598897728e-14 2.355199632576e-14 1.986699009792e-14 ] [ -2.098851373248e-14 8.33131842816e-15 3.909310954752e-14 ] [ -8.33131842816e-15 -1.12152363456e-15 3.220375007808e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.557231 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.254937462138501e-18 } }