{ "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" [ [ -0.290949 -4.8164207 -3.8888904 ] [ -3.5773365 -4.0066657 0.5566359 ] [ 1.2216709 1.7549977 3.8765394 ] [ -2.6956032 6.9659359 -1.4554899 ] [ -1.2118087 0.0790737 0.2836304 ] [ 4.4226125 -0.0877594 -0.2157414 ] [ 2.131414 0.1108386 0.8433161 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.66151689485666e-10 -7.716756705053924e-09 -6.230689331066913e-09 ] [ -5.73152495225534e-09 -6.419386164789253e-09 8.918290326255604e-10 ] [ 1.95733257041775e-09 2.811816307663742e-09 6.210900847460378e-09 ] [ -4.318832461575628e-09 1.116065973292176e-08 -2.331951908802996e-09 ] [ -1.941531584017916e-09 1.266900345039258e-10 4.544259995720736e-10 ] [ 7.085806408736324e-09 -1.406060600938596e-10 -3.456558300664476e-10 ] [ 3.414901708180475e-09 1.775830150652724e-10 1.351141350496007e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.914994064916392 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.389645498705772e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6343451 1.1822137 1.4439075 ] [ 1.3525179 0.9556351 4.4081529 ] [ 2.0541595 2.9521312 5.4943784 ] [ 2.238558 2.981812 3.0755856 ] [ 3.8771808 0.0027255 3.0496842 ] [ 4.5160326 2.6117299 2.1014621 ] [ 4.054691 1.9511951 4.4758853 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6343451e-10 1.1822137e-10 1.4439075e-10 ] [ 1.3525179e-10 9.556351e-11 4.4081529e-10 ] [ 2.0541595e-10 2.952131200000001e-10 5.494378400000001e-10 ] [ 2.238558e-10 2.981812e-10 3.0755856e-10 ] [ 3.8771808e-10 2.7255e-13 3.0496842e-10 ] [ 4.5160326e-10 2.6117299e-10 2.1014621e-10 ] [ 4.054691e-10 1.9511951e-10 4.4758853e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.33e-05 3.26e-05 0.0001035 ] [ 7.62e-05 -3.48e-05 -6.54e-05 ] [ 2.23e-05 6.29e-05 -2.44e-05 ] [ -1.21e-05 -3.9e-05 8.2e-06 ] [ -5.27e-05 2.28e-05 -3.96e-05 ] [ -4.57e-05 -3.39e-05 3.56e-05 ] [ -3.13e-05 -1.05e-05 -1.8e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.93742482522e-14 5.22309582684e-14 1.65825281619e-13 ] [ 1.220858595108e-13 -5.575574686319999e-14 -1.047823518636e-13 ] [ 3.572853893819999e-14 1.007769102786e-13 -3.909310986959999e-14 ] [ -1.93863372714e-14 -6.248488872599999e-14 1.31378483988e-14 ] [ -8.44347086118e-14 3.65296272552e-14 -6.34461947064e-14 ] [ -7.32194721738e-14 -5.431378789259999e-14 5.703748817039999e-14 ] [ -5.014812864419999e-14 -1.6822854657e-14 -2.8839179412e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.031240064916393 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.888923151405369e-18 } }