{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.007741 0.810981 1.851579 ] [ 2.28758 2.972606 1.775704 ] [ 2.775609 2.277586 3.884458 ] [ 3.461309 1.568578 0.4572952 ] [ 4.556331 2.173826 2.191246 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.007741e-10 8.10981e-11 1.851579e-10 ] [ 2.28758e-10 2.972606e-10 1.775704e-10 ] [ 2.775609000000001e-10 2.277586e-10 3.884458e-10 ] [ 3.461309e-10 1.568578e-10 4.572952e-11 ] [ 4.556331e-10 2.173826e-10 2.191246e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.596439 -13.647722 1.1272256 ] [ -9.1194171 14.3208861 -1.4119162 ] [ -0.070195 0.4046516 8.2735492 ] [ 4.7426293 -3.7174044 -12.5920106 ] [ 16.0434218 2.6395886 4.6031519 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.857954345033333e-08 -2.186606111557782e-08 1.806014502687253e-09 ] [ -1.461091687294374e-08 2.294458889855969e-08 -2.262139126168777e-09 ] [ -1.12464787897056e-10 6.483233330893132e-10 1.325568709927854e-08 ] [ 7.598529785581069e-09 -5.955938419739051e-09 -2.017462499218578e-08 ] [ 2.570439532559306e-08 4.229087143450203e-09 7.375062356171101e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.9298179 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.091909121781353e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.0794195 0.3347383 2.1019347 ] [ 2.1103202 3.5515864 1.6139126 ] [ 2.7116318 2.2059938 3.6294691 ] [ 3.3237976 1.7154331 0.4346452 ] [ 4.8634009 1.9958254 2.3803207 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0794195e-10 3.347383e-11 2.1019347e-10 ] [ 2.1103202e-10 3.5515864e-10 1.6139126e-10 ] [ 2.7116318e-10 2.2059938e-10 3.6294691e-10 ] [ 3.3237976e-10 1.7154331e-10 4.346452e-11 ] [ 4.863400900000001e-10 1.9958254e-10 2.3803207e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.11e-05 8.8e-06 1.9e-06 ] [ 4.7e-06 -1.1e-05 5.9e-06 ] [ -5e-07 4.4e-06 -1.13e-05 ] [ -2.2e-06 4.5e-06 3.8e-06 ] [ -1.32e-05 -6.7e-06 -3e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.778416049088e-14 1.409915426304e-14 3.04413557952e-15 ] [ 7.53023011776e-15 -1.76239428288e-14 9.45284206272e-15 ] [ -8.010883104e-16 7.04957713152e-15 -1.810459581504e-14 ] [ -3.52478856576e-15 7.2097947936e-15 6.08827115904e-15 ] [ -2.114873139456e-14 -1.073458335936e-14 -4.8065298624e-16 ] ] } "relaxed-potential-energy" { "source-value" -11.458486 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.835851837896411e-18 } }