{ "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" [ [ 1.839564 1.867321 2.162261 ] [ 1.684665 2.737292 4.133334 ] [ 1.168876 4.298629 2.101191 ] [ 4.284365 2.457862 3.031672 ] [ 3.236614 0.5901118 4.309357 ] [ 3.135041 3.239997 1.121025 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.839564e-10 1.867321e-10 2.162261e-10 ] [ 1.684665e-10 2.737292e-10 4.133334e-10 ] [ 1.168876e-10 4.298629e-10 2.101191e-10 ] [ 4.284365e-10 2.457862e-10 3.031672e-10 ] [ 3.236614e-10 5.901118e-11 4.309357e-10 ] [ 3.135041e-10 3.239997e-10 1.121025e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.798918 -5.2534459 -0.5897552 ] [ 1.2713291 1.4393919 3.505607 ] [ 0.4112356 -0.8908726 0.4964831 ] [ -1.5304928 -0.5262385 1.0114632 ] [ -1.509472 2.2155089 -1.9884583 ] [ 2.1563181 3.0156563 -2.4353398 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.280007741536295e-09 -8.416948199617614e-09 -9.448919934352284e-10 ] [ 2.036893761362705e-09 2.306160050348891e-09 5.616601577112826e-09 ] [ 6.588720639606605e-10 -1.42733525183131e-09 7.954536154423085e-10 ] [ -2.45211978246273e-09 -8.43127021664861e-10 1.620542691839555e-09 ] [ -2.418440748152217e-09 3.549636562754325e-09 -3.185861399695713e-09 ] [ 3.454802446827877e-09 4.831614020228231e-09 -3.901844491263748e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.787341 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.529410865479729e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9364224 1.6039076 2.0748161 ] [ 1.9971222 2.9910676 4.2798513 ] [ 1.1462139 3.9454209 2.2080481 ] [ 4.1753276 2.4870085 3.0735817 ] [ 2.8807923 0.6966951 4.1591842 ] [ 3.2132465 3.4671132 1.0633585 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9364224e-10 1.6039076e-10 2.0748161e-10 ] [ 1.9971222e-10 2.9910676e-10 4.2798513e-10 ] [ 1.1462139e-10 3.9454209e-10 2.2080481e-10 ] [ 4.1753276e-10 2.4870085e-10 3.0735817e-10 ] [ 2.8807923e-10 6.966951e-11 4.1591842e-10 ] [ 3.2132465e-10 3.4671132e-10 1.0633585e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.01e-05 -7.9e-06 3.9e-06 ] [ -4e-06 -4.4e-06 5.9e-06 ] [ -5.3e-06 2.9e-06 1e-05 ] [ -8.6e-06 -5e-06 -7.2e-06 ] [ -3.9e-06 1.48e-05 -5.5e-06 ] [ 1.17e-05 -5e-07 -7.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.618198387008e-14 -1.265719530432e-14 6.24848882112e-15 ] [ -6.4087064832e-15 -7.04957713152e-15 9.45284206272e-15 ] [ -8.491536090240001e-15 4.646312200320001e-15 1.6021766208e-14 ] [ -1.377871893888e-14 -8.010883104e-15 -1.153567166976e-14 ] [ -6.24848882112e-15 2.371221398784e-14 -8.8119714144e-15 ] [ 1.874546646336e-14 -8.010883104e-16 -1.137545400768e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.001462 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.884152155661961e-18 } }