{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5577694 2.945013 2.286605 ] [ 2.630246 0.191498 2.174801 ] [ 2.389079 2.171655 0.2590592 ] [ 2.979224 2.829603 2.740156 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.577694e-11 2.945013e-10 2.286605e-10 ] [ 2.630246e-10 1.91498e-11 2.174801e-10 ] [ 2.389079e-10 2.171655e-10 2.590592e-11 ] [ 2.979224e-10 2.829603e-10 2.740156e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7642906 -0.4975093 -0.663174 ] [ -0.0418883 2.5969316 -0.6918837 ] [ -0.434823 -0.5113819 2.6179568 ] [ -1.2875793 -1.5880405 -1.2628991 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.826705151617204e-09 -7.970977690905734e-10 -1.062521878322419e-09 ] [ -6.711245494505665e-11 4.160743095336738e-09 -1.108519888452601e-09 ] [ -6.966632447861184e-10 -8.193241244802834e-10 4.194429179224382e-09 ] [ -2.06292945188603e-09 -2.544321361983543e-09 -2.023387412449361e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.3970561 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.185139034616603e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1059516 3.3284734 1.8740392 ] [ 3.1721538 0.7403669 1.8562989 ] [ 1.6472434 1.6523083 0.3308693 ] [ 2.6309696 2.4166204 3.3994137 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1059516e-10 3.3284734e-10 1.8740392e-10 ] [ 3.1721538e-10 7.403669000000001e-11 1.8562989e-10 ] [ 1.6472434e-10 1.6523083e-10 3.308693e-11 ] [ 2.6309696e-10 2.4166204e-10 3.3994137e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.77e-05 8.4e-06 1.13e-05 ] [ -2.3e-06 4.49e-05 -2.86e-05 ] [ 1.1e-06 -3.57e-05 4.03e-05 ] [ -4.64e-05 -1.76e-05 -2.3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.642382481215999e-14 1.345828361472e-14 1.810459581504e-14 ] [ -3.68500622784e-15 7.193773027392e-14 -4.582225135488e-14 ] [ 1.76239428288e-15 -5.719770536256001e-14 6.456771781824e-14 ] [ -7.434099520512001e-14 -2.819830852608e-14 -3.68500622784e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.9297943 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.43071076560131e-18 } }