{ "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" [ [ 1.442259 2.324158 2.548252 ] [ 2.158618 1.41899 4.605472 ] [ 2.34516 4.213318 2.000238 ] [ 2.029556 3.900131 4.500233 ] [ 3.591834 1.471441 2.657937 ] [ 4.338938 2.513725 4.512162 ] [ 5.128703 3.807673 2.402827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.442259e-10 2.324158e-10 2.548252e-10 ] [ 2.158618e-10 1.41899e-10 4.605472e-10 ] [ 2.34516e-10 4.213318e-10 2.000238e-10 ] [ 2.029556e-10 3.900131e-10 4.500233e-10 ] [ 3.591834e-10 1.471441e-10 2.657937e-10 ] [ 4.338938e-10 2.513725e-10 4.512162e-10 ] [ 5.128703e-10 3.807673e-10 2.402827e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0577649 -1.1638935 -0.1694407 ] [ 0.012054 0.4885572 0.3366017 ] [ 3.1327101 0.6210844 0.9372878 ] [ 0.9486061 -0.8292908 -0.6782007 ] [ 0.42342 0.3969732 -1.3886701 ] [ 0.1962723 1.7917194 0.1630853 ] [ -3.6552976 -1.3051499 0.7993367 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.694726207045346e-09 -1.864762970164479e-09 -2.714739303886038e-10 ] [ 1.9312637146236e-11 7.827549302124648e-10 5.392953787046777e-10 ] [ 5.019154923315804e-09 9.950869134219095e-10 1.501700612493265e-09 ] [ 1.519834528289867e-09 -1.328670342551167e-09 -1.086597314702444e-09 ] [ 6.7839363036828e-10 6.360211853642088e-10 -2.224894786554443e-09 ] [ 3.144628929614382e-10 2.8706509573645e-09 2.612914570088801e-10 ] [ -5.856432405036278e-09 -2.091080673647436e-09 1.280678583438668e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.822096005765545 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.855414578934228e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4585466 2.2021967 2.2001177 ] [ 2.4117708 1.6708827 4.3420141 ] [ 2.4715606 4.2524297 2.4002723 ] [ 2.1957329 4.0425314 4.6695427 ] [ 3.6114724 1.1831707 2.316798 ] [ 4.3486826 3.0235553 4.7861879 ] [ 4.5373021 3.2746696 2.5121883 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4585466e-10 2.2021967e-10 2.2001177e-10 ] [ 2.4117708e-10 1.6708827e-10 4.3420141e-10 ] [ 2.4715606e-10 4.252429700000001e-10 2.4002723e-10 ] [ 2.1957329e-10 4.0425314e-10 4.6695427e-10 ] [ 3.6114724e-10 1.1831707e-10 2.316798e-10 ] [ 4.3486826e-10 3.0235553e-10 4.7861879e-10 ] [ 4.5373021e-10 3.2746696e-10 2.5121883e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.1e-06 -1.63e-05 1e-07 ] [ -1.32e-05 1.6e-05 -1.4e-06 ] [ -1.36e-05 -2.95e-05 1.05e-05 ] [ 3e-05 -5e-07 -2.76e-05 ] [ -1.63e-05 1.91e-05 -5.6e-06 ] [ 2.4e-06 -1.34e-05 2.5e-06 ] [ 9.5e-06 2.46e-05 2.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.7623942974e-15 -2.61154791342e-14 1.602176634e-16 ] [ -2.11487315688e-14 2.5634826144e-14 -2.2430472876e-15 ] [ -2.17896022224e-14 -4.726421070299999e-14 1.6822854657e-14 ] [ 4.806529901999999e-14 -8.010883169999999e-16 -4.42200750984e-14 ] [ -2.61154791342e-14 3.06015737094e-14 -8.972189150399999e-15 ] [ 3.845223921599999e-15 -2.14691668956e-14 4.005441585e-15 ] [ 1.5220678023e-14 3.94135451964e-14 3.46070152944e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.808943005765546 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.333960226207528e-18 } }