{ "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" [ [ 2.298469 1.653345 1.333865 ] [ 0.8562694 1.609736 3.078689 ] [ 0.6106735 3.571622 1.917701 ] [ 2.573163 3.601998 2.791817 ] [ 3.634663 1.831744 3.381139 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.298469e-10 1.653345e-10 1.333865e-10 ] [ 8.562694e-11 1.609736e-10 3.078689e-10 ] [ 6.106735e-11 3.571622e-10 1.917701e-10 ] [ 2.573163e-10 3.601998e-10 2.791817e-10 ] [ 3.634663e-10 1.831744e-10 3.381139e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3082337 0.1309945 -0.0966215 ] [ -0.2488614 -0.5680798 0.7425507 ] [ -2.0006779 0.1126455 -1.3760153 ] [ 1.2339235 2.2223203 0.5484161 ] [ 0.7073822 -1.8978806 0.18167 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.93844827882681e-10 2.098763253533856e-10 -1.548047083666272e-10 ] [ -3.987199168995571e-10 -9.101641743087399e-10 1.189697371298675e-09 ] [ -3.205439357131241e-09 1.804779865383264e-10 -2.204619543523099e-09 ] [ 1.976963383555709e-09 3.560549628589242e-09 8.786594538903149e-10 ] [ 1.13335122281007e-09 -3.040739926389877e-09 2.91067426700736e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -4.0694163992349495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.519923815154356e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.3294572 1.9201758 1.3123215 ] [ 0.9120818 1.2899157 3.0986642 ] [ 0.6454619 3.394701 2.0785749 ] [ 2.9098083 3.8842181 2.4967796 ] [ 3.1764286 1.7794344 3.5168708 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3294572e-10 1.9201758e-10 1.3123215e-10 ] [ 9.120818000000001e-11 1.2899157e-10 3.0986642e-10 ] [ 6.454619000000001e-11 3.394701e-10 2.0785749e-10 ] [ 2.9098083e-10 3.8842181e-10 2.4967796e-10 ] [ 3.1764286e-10 1.7794344e-10 3.5168708e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.5e-06 1.08e-05 4.6e-06 ] [ 2.3e-06 2.4e-06 3.6e-06 ] [ 4e-07 -5.2e-06 -2.4e-06 ] [ 0.0 -4.5e-06 -3.7e-06 ] [ -4.3e-06 -3.5e-06 -2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.4032649312e-15 1.730350750464e-14 7.370012455680001e-15 ] [ 3.68500622784e-15 3.84522388992e-15 5.76783583488e-15 ] [ 6.408706483200001e-16 -8.33131842816e-15 -3.84522388992e-15 ] [ 0.0 -7.2097947936e-15 -5.928053496960001e-15 ] [ -6.889359469440001e-15 -5.6076181728e-15 -3.36457090368e-15 ] ] } "relaxed-potential-energy" { "source-value" -5.34072039923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.55677736188388e-19 } }