{ "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" [ [ 2.464863 1.11645 1.673921 ] [ 1.905798 2.509771 3.967609 ] [ 1.228636 3.135192 1.685921 ] [ 4.446536 2.449344 1.565667 ] [ 4.18286 2.007242 3.638636 ] [ 3.206224 4.029955 3.010958 ] [ 5.270591 3.951163 3.865389 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.464863e-10 1.11645e-10 1.673921e-10 ] [ 1.905798e-10 2.509771000000001e-10 3.967609e-10 ] [ 1.228636e-10 3.135192e-10 1.685921e-10 ] [ 4.446536e-10 2.449344e-10 1.565667e-10 ] [ 4.18286e-10 2.007242e-10 3.638636e-10 ] [ 3.206224e-10 4.029955e-10 3.010958e-10 ] [ 5.270591e-10 3.951163e-10 3.865389e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5663379 -2.1761145 -0.4329936 ] [ -4.9027234 -3.2170213 3.3990216 ] [ -1.5289194 1.439298 -1.0639228 ] [ 1.622676 -0.5918674 -10.1289149 ] [ 1.5278519 -8.103901 7.3439299 ] [ -2.5327738 7.7999987 -3.740308 ] [ 6.3802266 4.8496075 4.6231878 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.073733503286285e-10 -3.486519804808593e-09 -6.937322285915423e-10 ] [ -7.855028874445035e-09 -5.154236357940304e-09 5.445832985981294e-09 ] [ -2.449598937949299e-09 2.306009624962932e-09 -1.704592250539855e-09 ] [ 2.599813571752583e-09 -9.482761187063315e-10 -1.622831078055444e-08 ] [ 2.447888614392504e-09 -1.298388082644923e-08 1.176627288751396e-08 ] [ -4.057951001567389e-09 1.249697566237037e-08 -5.992634081563272e-09 ] [ 1.022224997814527e-08 7.769927820571156e-09 7.407163467753865e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.180437 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.791303491930906e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0269491 1.2025659 1.342732 ] [ 2.2353974 2.0896766 3.7527931 ] [ 1.0202259 3.466316 1.8986793 ] [ 4.3205853 1.9928049 1.5986236 ] [ 4.6935372 1.9545181 4.0371531 ] [ 3.3918983 4.1680046 2.4868899 ] [ 5.0169148 4.3252309 4.2912299 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0269491e-10 1.2025659e-10 1.342732e-10 ] [ 2.2353974e-10 2.0896766e-10 3.7527931e-10 ] [ 1.0202259e-10 3.466316e-10 1.8986793e-10 ] [ 4.3205853e-10 1.9928049e-10 1.5986236e-10 ] [ 4.6935372e-10 1.9545181e-10 4.0371531e-10 ] [ 3.3918983e-10 4.1680046e-10 2.4868899e-10 ] [ 5.0169148e-10 4.3252309e-10 4.2912299e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0002644 0.0004319 -0.0001801 ] [ 0.0012807 -0.000252 -0.001071 ] [ -0.0002002 0.0001928 0.0002485 ] [ -0.0011233 -0.000349 0.0010964 ] [ 0.000513 -0.0012315 0.0008949 ] [ -0.00059 0.0008005 -0.000921 ] [ -0.0001447 0.0004074 -6.76e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.236155020295999e-13 6.919800882245999e-13 -2.885520117833999e-13 ] [ 2.0519076151638e-12 -4.03748511768e-13 -1.715931175014e-12 ] [ -3.207557621267999e-13 3.088996550352e-13 3.98140893549e-13 ] [ -1.7997250129722e-12 -5.591596452659999e-13 1.7566264615176e-12 ] [ 8.219166132419999e-13 -1.973080524771e-12 1.4337878697666e-12 ] [ -9.452842140599998e-13 1.282542395517e-12 -1.475604679914e-12 ] [ -2.318349589398e-13 6.527267606915999e-13 -1.083071404584e-13 ] ] } "relaxed-potential-energy" { "source-value" -17.192906 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.75460722637584e-18 } }