{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7699977 0.2576193 1.27547 ] [ 0.6265566 2.494782 0.6353127 ] [ 2.748297 1.297333 0.3747024 ] [ 2.66914 2.750152 1.670621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.699977e-11 2.576193e-11 1.27547e-10 ] [ 6.265566000000001e-11 2.494782e-10 6.353127e-11 ] [ 2.748297e-10 1.297333e-10 3.747024e-11 ] [ 2.66914e-10 2.750152e-10 1.670621e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3766234 -2.4469186 2.0587717 ] [ -5.8593906 3.8090853 -1.6762468 ] [ 6.0823291 -9.7983007 -9.9287093 ] [ 1.1536849 8.436134 9.5461843 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.205593827126207e-09 -3.920395773920667e-09 3.298515885304671e-09 ] [ -9.387778631455285e-09 6.102827414292954e-09 -2.685643433650813e-09 ] [ 9.744965484031504e-09 -1.569860830510828e-08 -1.590754591517953e-08 ] [ 1.848406974549986e-09 1.351617666473599e-08 1.529467330330801e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.93491382 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.49789706486682e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2201473 0.4672366 0.7669027 ] [ -0.1396805 2.2786737 1.1816625 ] [ 3.5466731 1.1212691 0.7963892 ] [ 3.1868514 2.9327069 1.2111517 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.201473e-11 4.672366e-11 7.669027000000001e-11 ] [ -1.396805e-11 2.2786737e-10 1.1816625e-10 ] [ 3.5466731e-10 1.1212691e-10 7.963892e-11 ] [ 3.1868514e-10 2.9327069e-10 1.2111517e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9e-06 -3e-06 -2.4e-06 ] [ 8.5e-06 5.9e-06 3.1e-06 ] [ 1.48e-05 1.7e-06 1.9e-06 ] [ -1.42e-05 -4.5e-06 -2.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.44195895872e-14 -4.8065298624e-15 -3.84522388992e-15 ] [ 1.36185012768e-14 9.45284206272e-15 4.96674752448e-15 ] [ 2.371221398784e-14 2.72370025536e-15 3.04413557952e-15 ] [ -2.275090801536e-14 -7.2097947936e-15 -4.16565921408e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.84507 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.179530719213946e-18 } }