{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5286717 0.5459164 0.2171681 ] [ 0.0530602 2.45185 0.0097729 ] [ 0.1982568 1.952172 2.366336 ] [ 2.940741 0.007829 0.5912968 ] [ 2.574768 0.9414562 2.330693 ] [ 2.158325 2.742494 1.504322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.286717e-11 5.459164e-11 2.171681e-11 ] [ 5.30602e-12 2.45185e-10 9.7729e-13 ] [ 1.982568e-11 1.952172e-10 2.366336e-10 ] [ 2.940741e-10 7.828999999999999e-13 5.912968e-11 ] [ 2.574768e-10 9.414562e-11 2.330693e-10 ] [ 2.158325e-10 2.742494e-10 1.504322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7567246 -6.8352402 0.5737334 ] [ -1.0200962 6.3345089 -0.1198782 ] [ -0.0362427 -0.4614279 -0.3114491 ] [ 0.0045654 -1.9206597 -4.3923236 ] [ -0.0292505 -1.677025 6.5137394 ] [ -0.6757006 4.5598439 -2.2638219 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.814583083304232e-09 -1.095126204599232e-08 9.192222400520947e-10 ] [ -1.634374282606921e-09 1.014900206382953e-08 -1.920660493835866e-10 ] [ -5.806720661466816e-11 -7.392889935648403e-10 -4.989964665892012e-10 ] [ 7.31457714460032e-12 -3.077236067852742e-09 -7.037278182908092e-09 ] [ -4.68644672467104e-11 -2.68689024749712e-09 1.043616098066382e-08 ] [ -1.082591703980532e-09 7.305675291077493e-09 -3.627042521835036e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.387787 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.305177595645017e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4080951 0.3124834 0.1401401 ] [ 0.3112284 2.6966557 0.4278676 ] [ 0.0026562 1.2445945 2.318037 ] [ 2.744716 0.3572347 0.5559742 ] [ 2.339277 1.289344 2.7338708 ] [ 2.6478499 2.7414053 0.8436989 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.080951e-11 3.124834000000001e-11 1.401401e-11 ] [ 3.112284e-11 2.6966557e-10 4.278676000000001e-11 ] [ 2.6562e-13 1.2445945e-10 2.318037e-10 ] [ 2.744716e-10 3.572347e-11 5.559742e-11 ] [ 2.339277e-10 1.289344e-10 2.7338708e-10 ] [ 2.6478499e-10 2.7414053e-10 8.436989e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.5e-06 -3.8e-06 -4.5e-06 ] [ -3.8e-06 6.6e-06 -8.7e-06 ] [ -6.6e-06 -4.1e-06 6.7e-06 ] [ 5.3e-06 -1.1e-05 -5.7e-06 ] [ 7.6e-06 1.9e-06 9.8e-06 ] [ 4e-06 1.04e-05 2.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.04141480352e-14 -6.08827115904e-15 -7.2097947936e-15 ] [ -6.08827115904e-15 1.057436569728e-14 -1.393893660096e-14 ] [ -1.057436569728e-14 -6.568924145279999e-15 1.073458335936e-14 ] [ 8.491536090240001e-15 -1.76239428288e-14 -9.13240673856e-15 ] [ 1.217654231808e-14 3.04413557952e-15 1.570133088384e-14 ] [ 6.4087064832e-15 1.666263685632e-14 3.84522388992e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.513765 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.806014482518531e-18 } }