{ "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" [ [ 0.7699977 0.2576193 1.27547 ] [ 0.6265566 2.494782 0.6353127 ] [ 2.748297 1.297333 0.3747024 ] [ 2.66914 2.750152 1.670621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.699977e-11 2.576193e-11 1.27547e-10 ] [ 6.265566000000001e-11 2.494782e-10 6.353127e-11 ] [ 2.748297e-10 1.297333e-10 3.747024e-11 ] [ 2.66914e-10 2.750152e-10 1.670621e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4842206 -12.1654718 2.7864065 ] [ -13.2382195 16.9096282 -2.2284148 ] [ 17.5773428 -120.1884111 -102.8559348 ] [ -3.8549027 115.4442546 102.2979431 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.758069246297486e-10 -1.949123449896169e-08 4.464315350345155e-09 ] [ -2.120996578391867e-08 2.709221096846039e-08 -3.570314094004708e-09 ] [ 2.816200768994721e-08 -1.925630623555192e-07 -1.647933740470891e-07 ] [ -6.176234981398796e-09 1.849620857258028e-07 1.638993727907487e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 14.926121 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.391428210543192e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4800228 -0.1034604 0.8082333 ] [ 0.5651004 2.4869108 1.0216908 ] [ 2.8298106 0.9921738 0.6059714 ] [ 2.9390575 3.424262 1.5202107 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.800228000000001e-11 -1.034604e-11 8.082333000000001e-11 ] [ 5.651004e-11 2.4869108e-10 1.0216908e-10 ] [ 2.8298106e-10 9.921738000000001e-11 6.059714e-11 ] [ 2.9390575e-10 3.424262e-10 1.5202107e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.51e-05 2.52e-05 -1.61e-05 ] [ 1.32e-05 -2.51e-05 1.29e-05 ] [ -2.62e-05 -1.6e-06 1.99e-05 ] [ -2.1e-06 1.6e-06 -1.68e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.419286697408e-14 4.037485084416e-14 -2.579504359488e-14 ] [ 2.114873139456e-14 -4.021463318208e-14 2.066807840832e-14 ] [ -4.197702746496e-14 -2.56348259328e-15 3.188331475392e-14 ] [ -3.36457090368e-15 2.56348259328e-15 -2.691656722944e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.675149 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03078273929565e-18 } }