{ "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" [ [ 1.662864 2.785445 0.9951273 ] [ 1.604551 1.254517 2.754062 ] [ 1.304297 2.979259 4.142484 ] [ 2.049326 4.702389 2.752286 ] [ 3.428978 2.585226 4.349041 ] [ 3.762165 3.432195 2.245626 ] [ 3.938407 4.831482 3.738967 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.662864e-10 2.785445e-10 9.951273000000001e-11 ] [ 1.604551e-10 1.254517e-10 2.754062e-10 ] [ 1.304297e-10 2.979259e-10 4.142484e-10 ] [ 2.049326e-10 4.702389e-10 2.752286e-10 ] [ 3.428978e-10 2.585226e-10 4.349041e-10 ] [ 3.762165e-10 3.432195e-10 2.245626e-10 ] [ 3.938407e-10 4.831482000000001e-10 3.738967e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.6856585 1.5206366 8.1614721 ] [ 2.9247573 5.6238856 -0.6018562 ] [ 0.3217347 3.1088933 -4.7163523 ] [ -7.1928054 -6.2134205 -1.8030981 ] [ 1.1667751 3.7467625 -5.6942197 ] [ -5.8161131 -15.8488826 -11.7302913 ] [ 4.9099927 8.0621251 16.3843456 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.905075880952797e-09 2.436328409252801e-09 1.307611978993148e-08 ] [ 4.685977767574132e-09 9.010458026373782e-09 -9.64279932723529e-10 ] [ 5.154758144401017e-10 4.980996161821761e-09 -7.556429390516308e-09 ] [ -1.152414464984399e-08 -9.954997060299446e-09 -2.888881620828901e-09 ] [ 1.869379786951582e-09 6.002975281190161e-09 -9.12314567703879e-09 ] [ -9.318440432748612e-09 -2.539270916752392e-08 -1.879399847603364e-08 ] [ 7.866675512238668e-09 1.291694834918486e-08 2.625061546742735e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -36.526293 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.85215726890907e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3456819 2.9698554 1.5492391 ] [ 2.2245852 1.3677788 2.8155719 ] [ 1.6544377 3.3027116 3.7076351 ] [ 2.1114792 4.9236473 2.2833858 ] [ 3.5335718 2.3314341 4.3323562 ] [ 3.41716 3.146006 2.2859607 ] [ 3.4636722 4.5290798 4.0034445 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3456819e-10 2.9698554e-10 1.5492391e-10 ] [ 2.2245852e-10 1.3677788e-10 2.8155719e-10 ] [ 1.6544377e-10 3.3027116e-10 3.7076351e-10 ] [ 2.1114792e-10 4.9236473e-10 2.2833858e-10 ] [ 3.5335718e-10 2.3314341e-10 4.332356200000001e-10 ] [ 3.41716e-10 3.146006e-10 2.2859607e-10 ] [ 3.4636722e-10 4.5290798e-10 4.0034445e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.01e-05 7e-07 -3.73e-05 ] [ 1.62e-05 0.0001651 -4.57e-05 ] [ 4.31e-05 3.74e-05 9.03e-05 ] [ 5.05e-05 -0.0001659 -3.63e-05 ] [ 3.91e-05 4.21e-05 -7.25e-05 ] [ -0.0001684 1.1e-06 0.0001072 ] [ -5.05e-05 -8.05e-05 -5.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.1231258111808e-13 1.12152363456e-15 -5.976118795584e-14 ] [ 2.595526125696e-14 2.6451936009408e-13 -7.321947157056e-14 ] [ 6.905381235648e-14 5.992140561792e-14 1.4467654885824e-13 ] [ 8.090991935040001e-14 -2.6580110139072e-13 -5.815901133504e-14 ] [ 6.264510587328001e-14 6.745163573568001e-14 -1.16157805008e-13 ] [ -2.698065429427201e-13 1.76239428288e-15 1.7175333374976e-13 ] [ -8.090991935040001e-14 -1.289752179744e-13 -9.13240673856e-15 ] ] } "relaxed-potential-energy" { "source-value" -52.328123 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.383889528094676e-18 } }