{ "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" [ [ 0.291373 0.2175772 2.382477 ] [ 0.160359 2.066003 1.905678 ] [ 1.191739 1.933254 2.911087 ] [ 2.962853 1.944071 0.1667647 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.91373e-11 2.175772e-11 2.382477e-10 ] [ 1.60359e-11 2.066003e-10 1.905678e-10 ] [ 1.191739e-10 1.933254e-10 2.911087e-10 ] [ 2.962853e-10 1.944071e-10 1.667647e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.6095052 -25.4776795 1.4514174 ] [ 76.0833508 1.9916059 78.1914001 ] [ -77.3498897 22.1500114 -71.2417221 ] [ 8.8760441 1.3360622 -8.4010954 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.219177132729603e-08 -4.081974244713543e-08 2.325427025302322e-09 ] [ 1.21898965883885e-07 3.190904410827343e-09 1.252764331878388e-07 ] [ -1.239281848987987e-07 3.548823041553348e-08 -1.141418215741507e-07 ] [ 1.422099034220978e-08 2.140607620774614e-09 -1.346003863899043e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 118.79397 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.903289214260166e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.2451977 0.0629268 2.3912801 ] [ 0.6722071 2.0729028 2.4294694 ] [ 0.6722071 2.0729028 2.4294694 ] [ 3.0167122 1.9521728 0.1157877 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.451977e-11 6.292680000000001e-12 2.3912801e-10 ] [ 6.722071e-11 2.0729028e-10 2.4294694e-10 ] [ 6.722071e-11 2.0729028e-10 2.4294694e-10 ] [ 3.0167122e-10 1.9521728e-10 1.157877e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.8207818 -28.3512063 1.2144673 ] [ -2.2609208071022046e+110 4.521841614204409e+110 3.54755 ] [ 2.2609208071022046e+110 -4.521841614204409e+110 3.54755 ] [ 8.7734982 1.0894103 -8.3095674 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.253027375633814e-08 -4.542363990533767e-08 1.9457911147861e-09 ] [ -3.622394458619419e+101 7.244788917238838e+101 5.68380167111904e-09 ] [ 3.622394458619419e+101 -7.244788917238838e+101 5.68380167111904e-09 ] [ 1.405669369867088e-08 1.745427713118714e-09 -1.331339461724184e-08 ] ] } "relaxed-potential-energy" { "source-value" -4.1835439e+94 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.702776228670454e+75 } }