{ "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" [ [ 2.272226 1.517825 2.823083 ] [ 2.079314 3.025232 4.309487 ] [ 1.624731 3.89644 2.167347 ] [ 4.204366 1.580563 1.938725 ] [ 4.130904 2.338344 4.256427 ] [ 3.588528 3.628489 1.149971 ] [ 3.881136 4.134812 3.114475 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.272226e-10 1.517825e-10 2.823083e-10 ] [ 2.079314e-10 3.025232e-10 4.309487e-10 ] [ 1.624731e-10 3.89644e-10 2.167347e-10 ] [ 4.204366000000001e-10 1.580563e-10 1.938725e-10 ] [ 4.130904e-10 2.338344e-10 4.256427000000001e-10 ] [ 3.588528e-10 3.628489e-10 1.149971e-10 ] [ 3.881136e-10 4.134812e-10 3.114475e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.9804463 -12.5119522 -2.7860726 ] [ -7.5031243 1.4516474 8.0239998 ] [ -7.8928298 3.1907423 -3.7697845 ] [ 3.6935886 -5.5483923 -4.8552307 ] [ 8.5146465 -2.3160042 6.7408698 ] [ 2.8660139 1.424511 -7.6249908 ] [ 9.3021515 14.309448 4.2712089 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.438826110620986e-08 -2.004635729540713e-08 -4.46378038357147e-09 ] [ -1.202133033641637e-08 2.325795525925106e-09 1.285586488486388e-08 ] [ -1.264570737751354e-08 5.11213271605762e-09 -6.039860591354218e-09 ] [ 5.917781301773403e-09 -8.88950442608674e-09 -7.778937116130419e-09 ] [ 1.364196755667655e-08 -3.710647782914608e-09 1.080006399741677e-08 ] [ 4.591860465467829e-09 2.282318220272429e-09 -1.221658199357509e-08 ] [ 1.490368965643965e-08 2.292626304215332e-08 6.843231042132886e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.6272541 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.413678337520946e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.9639985 0.8212536 2.7309973 ] [ 1.8092328 2.67187 4.0895952 ] [ 1.5634827 4.043202 2.2929498 ] [ 4.0366815 1.5747673 2.075883 ] [ 4.1434076 2.6970337 4.2394403 ] [ 3.5653432 3.7178157 1.2655452 ] [ 4.6990587 4.5957628 3.0651043 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9639985e-10 8.212536e-11 2.7309973e-10 ] [ 1.8092328e-10 2.67187e-10 4.0895952e-10 ] [ 1.5634827e-10 4.043202e-10 2.2929498e-10 ] [ 4.0366815e-10 1.5747673e-10 2.075883e-10 ] [ 4.1434076e-10 2.6970337e-10 4.2394403e-10 ] [ 3.5653432e-10 3.7178157e-10 1.2655452e-10 ] [ 4.6990587e-10 4.595762800000001e-10 3.0651043e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.6e-05 -2.42e-05 7.9e-06 ] [ 1.06e-05 -1.29e-05 1.05e-05 ] [ -1.12e-05 1.1e-05 -1.04e-05 ] [ -1.63e-05 -2.1e-06 -5.7e-06 ] [ -3.7e-06 4e-06 -2.35e-05 ] [ 2.21e-05 -1.33e-05 5e-07 ] [ 1.45e-05 3.75e-05 2.06e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.56348259328e-14 -3.877267422336e-14 1.265719530432e-14 ] [ 1.698307218048e-14 -2.066807840832e-14 1.68228545184e-14 ] [ -1.794437815296e-14 1.76239428288e-14 -1.666263685632e-14 ] [ -2.611547891904e-14 -3.36457090368e-15 -9.13240673856e-15 ] [ -5.928053496960001e-15 6.4087064832e-15 -3.76511505888e-14 ] [ 3.540810331968e-14 -2.130894905664e-14 8.010883104e-16 ] [ 2.32315610016e-14 6.008162327999999e-14 3.300483838848e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.23956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.281429012247885e-18 } }