{ "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" [ [ 2.1688 2.788884 1.320769 ] [ 2.532136 2.630615 3.81334 ] [ 3.448306 1.022917 2.319133 ] [ 4.871015 2.854538 3.444822 ] [ 3.148673 5.011898 0.914954 ] [ 4.462028 3.106005 1.382629 ] [ 3.536809 5.003724 3.350012 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1688e-10 2.788884e-10 1.320769e-10 ] [ 2.532136e-10 2.630615e-10 3.813340000000001e-10 ] [ 3.448306e-10 1.022917e-10 2.319133e-10 ] [ 4.871015e-10 2.854538e-10 3.444822e-10 ] [ 3.148673e-10 5.011898e-10 9.149540000000001e-11 ] [ 4.462028e-10 3.106005e-10 1.382629e-10 ] [ 3.536809e-10 5.003724e-10 3.350012e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.137914 -0.6856097 -3.1367091 ] [ -3.7940652 0.115558 4.1640805 ] [ -0.2363915 -5.1177647 -0.3891228 ] [ 3.7228651 0.8625304 3.0806132 ] [ -0.2011191 1.1483931 0.34445 ] [ 4.7670222 0.087022 -6.2381491 ] [ -0.1203975 3.5898709 2.1748372 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.629669069681012e-09 -1.098467832333702e-09 -5.025561986270609e-09 ] [ -6.078762561230876e-09 1.851443259464064e-10 6.671592424229175e-09 ] [ -3.787409346558432e-10 -8.199562953095528e-09 -6.234434527802342e-10 ] [ 5.964687425612253e-09 1.381926041609272e-09 4.935686446767875e-09 ] [ -3.222283200163373e-10 1.839928576308036e-09 5.5186973703456e-10 ] [ 7.637611519674582e-09 1.394246138952576e-10 -9.994616645084562e-09 ] [ -1.92898059702768e-10 5.751607227670255e-09 3.484473315886133e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.026525 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.407514704686672e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.533413 2.8633861 1.2181011 ] [ 1.8551852 2.8956739 3.9336047 ] [ 3.569891 1.2483923 2.3729708 ] [ 5.3978304 3.1064066 3.511288 ] [ 3.2258503 4.6010632 1.1598823 ] [ 5.0760495 3.0741488 0.7958144 ] [ 3.5095475 4.6295102 3.5539977 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.533413e-10 2.8633861e-10 1.2181011e-10 ] [ 1.8551852e-10 2.8956739e-10 3.9336047e-10 ] [ 3.569891e-10 1.2483923e-10 2.3729708e-10 ] [ 5.397830400000001e-10 3.1064066e-10 3.511288e-10 ] [ 3.2258503e-10 4.6010632e-10 1.1598823e-10 ] [ 5.0760495e-10 3.0741488e-10 7.958144e-11 ] [ 3.5095475e-10 4.6295102e-10 3.5539977e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.26e-05 2.33e-05 -1.54e-05 ] [ -4.31e-05 -1.87e-05 4.41e-05 ] [ 1e-07 -1.8e-06 1.02e-05 ] [ 7.9e-06 2.57e-05 3.71e-05 ] [ -1.94e-05 -6.5e-06 -6.94e-05 ] [ 4.01e-05 1.47e-05 -3.37e-05 ] [ 4.7e-05 -3.68e-05 2.71e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.223095783807999e-14 3.733071526464e-14 -2.467351996032e-14 ] [ -6.905381235648e-14 -2.996070280896e-14 7.065598897728e-14 ] [ 1.6021766208e-16 -2.88391791744e-15 1.634220153216e-14 ] [ 1.265719530432e-14 4.117593915456e-14 5.944075263168e-14 ] [ -3.108222644352e-14 -1.04141480352e-14 -1.1119105748352e-13 ] [ 6.424728249408e-14 2.355199632576e-14 -5.399335212096e-14 ] [ 7.530230117759999e-14 -5.896009964544001e-14 4.341898642368e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.475174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.280484508961202e-18 } }