{ "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" [ [ 1.888839 2.682802 2.483288 ] [ 4.584027 1.697115 1.780244 ] [ 5.622084 2.160801 4.094107 ] [ 3.250182 0.9950144 3.979579 ] [ 5.691266 3.575432 2.207922 ] [ 3.710937 3.502612 1.042458 ] [ 3.524601 3.924526 3.14177 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.888839e-10 2.682802e-10 2.483288e-10 ] [ 4.584027e-10 1.697115e-10 1.780244e-10 ] [ 5.622084000000001e-10 2.160801e-10 4.094107000000001e-10 ] [ 3.250182e-10 9.950144e-11 3.979579e-10 ] [ 5.691266e-10 3.575432e-10 2.207922e-10 ] [ 3.710937e-10 3.502612e-10 1.042458e-10 ] [ 3.524601e-10 3.924526e-10 3.14177e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.8074393 -9.6069421 -3.5013479 ] [ 0.5358708 -27.4459381 1.7350888 ] [ 0.2078124 -2.4533915 3.8847003 ] [ 0.6151359 0.4824993 -1.1482837 ] [ 24.3689443 11.9070676 2.7604168 ] [ -15.1821245 10.9474287 -27.5625115 ] [ 1.2618003 16.1692761 23.8319372 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.891760335383331e-08 -1.539201815681089e-08 -5.609777792884968e-09 ] [ 8.58559674602887e-10 -4.397324072203035e-08 2.779918733275099e-09 ] [ 3.329521715354616e-10 -3.93076653535421e-09 6.22397605075279e-09 ] [ 9.855563657145603e-10 7.730491043813561e-10 -1.839753313343066e-09 ] [ 3.904335315270748e-08 1.907722548817845e-08 4.42267529706105e-09 ] [ -2.432444512837893e-08 1.753971446552099e-08 -4.416001189965629e-08 ] [ 2.02162695743419e-09 2.590603635611465e-08 3.818297292479538e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -8.51704 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.364580247884336e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8084155 2.7578006 2.8264164 ] [ 4.9415807 1.2453905 1.6688043 ] [ 5.1670915 2.3131946 4.2285627 ] [ 3.1836057 0.7672755 3.5356605 ] [ 5.9356502 3.7373491 2.0542532 ] [ 3.5050606 3.3247564 0.927952 ] [ 3.7305317 4.3925356 3.487719 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8084155e-10 2.7578006e-10 2.8264164e-10 ] [ 4.941580700000001e-10 1.2453905e-10 1.6688043e-10 ] [ 5.1670915e-10 2.3131946e-10 4.228562700000001e-10 ] [ 3.1836057e-10 7.672755e-11 3.5356605e-10 ] [ 5.935650200000001e-10 3.7373491e-10 2.0542532e-10 ] [ 3.5050606e-10 3.3247564e-10 9.27952e-11 ] [ 3.7305317e-10 4.3925356e-10 3.487719e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.18e-05 4e-06 9.9e-06 ] [ -2.1e-06 2.77e-05 2.31e-05 ] [ -1.14e-05 3.5e-06 3.6e-06 ] [ 1.7e-06 -2.7e-05 -2.05e-05 ] [ -4.94e-05 -6.7e-06 9.5e-06 ] [ 4e-06 -9e-06 -8.5e-06 ] [ 4.54e-05 7.4e-06 -1.71e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.89056842812e-14 6.408706535999999e-15 1.58615486766e-14 ] [ -3.364570931399999e-15 4.438029276179999e-14 3.70102802454e-14 ] [ -1.82648136276e-14 5.607618218999999e-15 5.767835882399999e-15 ] [ 2.7237002778e-15 -4.325876911799999e-14 -3.2844620997e-14 ] [ -7.91475257196e-14 -1.07345834478e-14 1.5220678023e-14 ] [ 6.408706535999999e-15 -1.4419589706e-14 -1.3618501389e-14 ] [ 7.273881918359998e-14 1.18561070916e-14 -2.73972204414e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.010874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.846966128471812e-18 } }