{ "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" [ [ 2.024908 1.18877 2.927879 ] [ 1.938594 2.418534 4.826435 ] [ 2.412467 3.694527 2.059811 ] [ 3.090256 4.25078 4.272664 ] [ 3.913894 1.726388 1.808826 ] [ 4.03064 2.069757 3.989682 ] [ 4.599294 3.851686 2.39416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.024908e-10 1.18877e-10 2.927879e-10 ] [ 1.938594e-10 2.418534e-10 4.826435e-10 ] [ 2.412467e-10 3.694527e-10 2.059811e-10 ] [ 3.090256e-10 4.25078e-10 4.272664e-10 ] [ 3.913894e-10 1.726388e-10 1.808826e-10 ] [ 4.03064e-10 2.069757e-10 3.989682e-10 ] [ 4.599294e-10 3.851686e-10 2.39416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.6443705 -5.3554627 -2.8661011 ] [ -5.9092582 -1.0559959 5.000747 ] [ -9.2318169 4.7023214 -5.9311545 ] [ -1.0896414 8.2487278 4.7197161 ] [ 3.3335697 -6.0749859 -7.7309729 ] [ 11.9760006 -5.9548671 9.630395 ] [ 8.5655166 5.4902623 -2.8226296 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.22476317967389e-08 -8.58039720219855e-09 -4.592000213101697e-09 ] [ -9.467675412312898e-09 -1.691891956579801e-09 8.012079995945596e-09 ] [ -1.479100132654631e-08 7.533949472638166e-09 -9.502757152543953e-09 ] [ -1.745797990519048e-09 1.321591894138622e-08 7.561818854533608e-09 ] [ 5.340967481150389e-09 -9.733200460859459e-09 -1.238638413846722e-08 ] [ 1.918766833008998e-08 -9.540748926195341e-09 1.542959384519043e-08 ] [ 1.372347055465912e-08 8.796369971591098e-09 -4.522351191556766e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.2124873 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.155567862508175e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7187133 1.6145784 2.463879 ] [ 2.1522891 2.1297201 4.8473268 ] [ 1.883856 4.042365 1.8813489 ] [ 3.0065988 4.4059232 4.2306449 ] [ 4.1554412 1.3383447 2.1171446 ] [ 4.6113833 1.8463793 4.5190645 ] [ 4.4817713 3.8231313 2.2200483 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7187133e-10 1.6145784e-10 2.463879e-10 ] [ 2.1522891e-10 2.1297201e-10 4.847326800000001e-10 ] [ 1.883856e-10 4.042365e-10 1.8813489e-10 ] [ 3.0065988e-10 4.4059232e-10 4.2306449e-10 ] [ 4.1554412e-10 1.3383447e-10 2.1171446e-10 ] [ 4.6113833e-10 1.8463793e-10 4.5190645e-10 ] [ 4.4817713e-10 3.8231313e-10 2.2200483e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.24e-05 2.52e-05 3.5e-06 ] [ 4.1e-05 -7.4e-06 1.46e-05 ] [ 5.23e-05 -1.56e-05 -2.1e-06 ] [ -7.26e-05 2.3e-05 9.1e-06 ] [ 3e-06 1.51e-05 3.02e-05 ] [ -2e-07 -5.68e-05 -4.4e-06 ] [ -1.2e-06 1.66e-05 -5.09e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.588875660159999e-14 4.037485117679999e-14 5.607618218999999e-15 ] [ 6.568924199399999e-14 -1.18561070916e-14 2.33917788564e-14 ] [ 8.379383795819998e-14 -2.49939554904e-14 -3.364570931399999e-15 ] [ -1.163180236284e-13 3.6850062582e-14 1.45798073694e-14 ] [ 4.806529901999999e-15 2.41928671734e-14 4.838573434679999e-14 ] [ -3.204353268e-16 -9.100363281119999e-14 -7.0495771896e-15 ] [ -1.9226119608e-15 2.65961321244e-14 -8.155079067059998e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.346236 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.939391064104962e-18 } }