{ "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" [ [ 2.376748 2.356906 1.723048 ] [ 1.891208 1.427855 3.861744 ] [ 2.621896 4.609245 2.418974 ] [ 4.560356 2.199202 1.122098 ] [ 4.097908 2.987714 3.135416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.376748e-10 2.356906e-10 1.723048e-10 ] [ 1.891208e-10 1.427855e-10 3.861744e-10 ] [ 2.621896e-10 4.609245e-10 2.418974e-10 ] [ 4.560356e-10 2.199202e-10 1.122098e-10 ] [ 4.097908e-10 2.987714e-10 3.135416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.7520609 -5.7553176 -6.7473015 ] [ 14.8607515 10.2516309 -4.7156761 ] [ -2.8267769 6.9234682 -0.0297051 ] [ 5.6842239 -2.7393058 -5.7901839 ] [ -4.9661376 -8.6804757 17.2828666 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.043105384099781e-08 -9.221035303998765e-09 -1.081036871678877e-08 ] [ 2.380954862081853e-08 1.642492335305086e-08 -7.555345998685322e-09 ] [ -4.5289958613975e-09 1.109261888489226e-08 -4.759281673852609e-11 ] [ 9.107130639972597e-09 -4.388851709981841e-09 -9.276897274712566e-09 ] [ -7.956629558395822e-09 -1.390765522396252e-08 2.769020480692518e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -11.273579 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.806226470654184e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1774041 2.4416118 1.544427 ] [ 2.2077692 1.4413882 3.7639698 ] [ 2.5723737 4.6831173 2.4089162 ] [ 4.5487526 2.0239397 1.1838878 ] [ 4.0418164 2.9908651 3.3600793 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1774041e-10 2.4416118e-10 1.544427e-10 ] [ 2.2077692e-10 1.4413882e-10 3.7639698e-10 ] [ 2.5723737e-10 4.683117300000001e-10 2.4089162e-10 ] [ 4.548752600000001e-10 2.0239397e-10 1.1838878e-10 ] [ 4.0418164e-10 2.9908651e-10 3.3600793e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.24e-05 -3.04e-05 -2.67e-05 ] [ -2.14e-05 8.7e-06 1.34e-05 ] [ -1.4e-06 1.12e-05 -5e-07 ] [ 1.46e-05 2e-05 -1.2e-05 ] [ 4.06e-05 -9.3e-06 2.57e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.191052251392001e-14 -4.870616927232e-14 -4.277811577536e-14 ] [ -3.428657968511999e-14 1.393893660096e-14 2.146916671872e-14 ] [ -2.24304726912e-15 1.794437815296e-14 -8.010883104e-16 ] [ 2.339177866368e-14 3.2043532416e-14 -1.92261194496e-14 ] [ 6.504837080448e-14 -1.490024257344e-14 4.117593915456e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.079847 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.576275492944102e-18 } }