{ "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" [ [ 0.1139215 0.7675217 1.173379 ] [ 0.3197986 0.4128002 2.663942 ] [ 1.547269 0.0076724 0.5415715 ] [ 1.777725 2.329132 1.457723 ] [ 2.606996 1.505358 2.342036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.139215e-11 7.675217e-11 1.173379e-10 ] [ 3.197986e-11 4.128002e-11 2.663942e-10 ] [ 1.547269e-10 7.672400000000001e-13 5.415715e-11 ] [ 1.777725e-10 2.329132e-10 1.457723e-10 ] [ 2.606996e-10 1.505358e-10 2.342036e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -43.5608067 49.0876564 -85.1038264 ] [ 12.3506975 -25.8210713 104.8087775 ] [ 33.8746757 -26.238721 -22.834107 ] [ -91.1260022 86.3873627 -93.8504142 ] [ 88.4614356 -83.4152269 96.9795701 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.979210665293064e-08 7.864709610190056e-08 -1.363513621220723e-07 ] [ 1.978799894810221e-08 -4.1369917101708e-08 1.679221743486049e-07 ] [ 5.427321389086758e-08 -4.203906569224512e-08 -3.658427269365583e-08 ] [ -1.459999514746726e-07 1.384078139908231e-07 -1.503649407224618e-07 ] [ 1.417308451284158e-07 -1.336459274589882e-07 1.55378401189585e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 64.614459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.03523776428351e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.2397942 0.8990734 0.9473672 ] [ 0.6807649 0.0657534 3.2444825 ] [ 1.1997516 -0.7149295 -0.5433179 ] [ 1.8568394 2.7798568 1.0632966 ] [ 2.38856 1.9927302 3.4668232 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.397942e-11 8.990734e-11 9.473672e-11 ] [ 6.807649e-11 6.575340000000001e-12 3.2444825e-10 ] [ 1.1997516e-10 -7.149295e-11 -5.433179000000001e-11 ] [ 1.8568394e-10 2.7798568e-10 1.0632966e-10 ] [ 2.38856e-10 1.9927302e-10 3.4668232e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.18e-05 -3.67e-05 -1.6e-06 ] [ -3.6e-06 1.28e-05 3.5e-06 ] [ 1.4e-06 3.09e-05 1.7e-06 ] [ 1.02e-05 -7.1e-06 -9.5e-06 ] [ 3.8e-06 1e-07 5.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.89056842812e-14 -5.879988246779999e-14 -2.5634826144e-15 ] [ -5.767835882399999e-15 2.05078609152e-14 5.607618218999999e-15 ] [ 2.2430472876e-15 4.950725799059999e-14 2.7237002778e-15 ] [ 1.63422016668e-14 -1.13754541014e-14 -1.5220678023e-14 ] [ 6.088271209199999e-15 1.602176634e-16 9.2926244772e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196954159838e-18 } }