{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.247505 0.2174365 0.42208 ] [ 0.0506875 0.0915851 2.362651 ] [ 1.429891 2.603248 1.463699 ] [ 0.6097234 2.164425 2.912732 ] [ 2.744149 0.6540612 0.6213704 ] [ 2.652131 2.68783 0.0915898 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.247505e-10 2.174365e-11 4.2208e-11 ] [ 5.068750000000001e-12 9.15851e-12 2.362651e-10 ] [ 1.429891e-10 2.603248e-10 1.463699e-10 ] [ 6.097234e-11 2.164425e-10 2.912732e-10 ] [ 2.744149e-10 6.540612e-11 6.213704e-11 ] [ 2.652131e-10 2.68783e-10 9.15898e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -54.604511 -26.6467156 -20.0563515 ] [ -1.7390404 -4.3693128 4.3336567 ] [ -4.7990135 29.3087107 -6.809425 ] [ -12.5396988 -6.6310776 28.8405964 ] [ 58.931418 0.1054288 10.2974097 ] [ 14.7508457 8.2329665 -16.6058864 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.748607091441643e-08 -4.269274475542664e-08 -3.213381747184702e-08 ] [ -2.78624987150668e-09 -7.000410817122187e-09 6.943283447313279e-09 ] [ -7.688867232603581e-09 4.69577310693308e-08 -1.090990153609104e-08 ] [ -2.009081224923382e-08 -1.062415750143057e-08 4.620772928200864e-08 ] [ 9.44185401501923e-08 1.68915558518999e-10 1.649826907613914e-08 ] [ 2.363346011756821e-08 1.31906664461296e-08 -2.660556295774068e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 32.336573 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.180890125739252e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1642539 -0.0765418 0.4476402 ] [ 0.0681356 0.1743409 2.2853609 ] [ 1.1414056 3.6968418 1.0593575 ] [ 0.6363117 1.7587628 3.3396852 ] [ 3.1779647 -0.0277326 0.6912335 ] [ 2.5460155 2.8929146 0.050845 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1642539e-10 -7.65418e-12 4.476402e-11 ] [ 6.81356e-12 1.743409e-11 2.2853609e-10 ] [ 1.1414056e-10 3.6968418e-10 1.0593575e-10 ] [ 6.363117000000001e-11 1.7587628e-10 3.3396852e-10 ] [ 3.1779647e-10 -2.77326e-12 6.912335e-11 ] [ 2.5460155e-10 2.8929146e-10 5.0845e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.3523942 -0.3772818 0.1765766 ] [ 0.2347701 -0.6699038 0.1568158 ] [ 1.5163508 0.3109524 -0.2307435 ] [ -0.0844235 -0.0784559 -0.8393231 ] [ -0.0393125 -0.0894583 0.5012926 ] [ -1.2749906 0.9041474 0.2353815 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.645977485455193e-10 -6.044720794133414e-10 2.829069003003533e-10 ] [ 3.761431654828781e-10 -1.073304206545079e-09 2.512466085320487e-10 ] [ 2.429461800691377e-09 4.9820066546165e-10 -3.696918411015648e-10 ] [ -1.352613579461088e-10 -1.257002087438227e-10 -1.34474384811738e-09 ] [ -6.29855684052e-11 -1.433279967965126e-10 8.031592839000461e-10 ] [ -2.042760131059764e-09 1.448603826037106e-09 3.771227362688352e-10 ] ] } "relaxed-potential-energy" { "source-value" -28.397614 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.549799323730278e-18 } }