{ "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" [ [ 1.498941 0.2917441 1.412179 ] [ 0.7321813 1.344758 2.47059 ] [ 0.7391833 1.573141 0.3619984 ] [ 0.011627 2.973124 1.6693 ] [ 2.701347 1.320916 0.403113 ] [ 2.713757 1.097636 2.168947 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.498941e-10 2.917441e-11 1.412179e-10 ] [ 7.321813e-11 1.344758e-10 2.47059e-10 ] [ 7.391833000000001e-11 1.573141e-10 3.619984e-11 ] [ 1.1627e-12 2.973124e-10 1.6693e-10 ] [ 2.701347e-10 1.320916e-10 4.03113e-11 ] [ 2.713757e-10 1.097636e-10 2.168947e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.9743985 -58.0939654 -12.9150985 ] [ -22.5673475 10.4912425 31.403722 ] [ -16.7347732 12.3429131 -21.8982644 ] [ -7.5178483 13.6361372 -0.9937536 ] [ 21.5187234 10.7265451 -30.5513961 ] [ 39.275644 10.8971274 34.9547906 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.238945456644259e-08 -9.307679317344413e-08 -2.069226887202914e-08 ] [ -3.615687655796933e-08 1.680882345664334e-08 5.031430919450261e-08 ] [ -2.68120623754304e-08 1.977552680138605e-08 -3.508488725777693e-08 ] [ -1.204492078498102e-08 2.184750021986118e-08 -1.592168784755835e-09 ] [ 3.447679554094188e-08 1.71858197811768e-08 -4.89487325642203e-08 ] [ 6.292651858366379e-08 1.745912275415909e-08 5.600374828427961e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 8.3277616 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.3342544939116e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.185126 0.1248944 1.2982907 ] [ 0.8142926 1.4847812 3.1843334 ] [ 0.674986 1.8132161 -0.2616097 ] [ -0.2826971 2.7976234 1.6123697 ] [ 2.9551792 1.3023563 0.1517452 ] [ 3.0501498 1.0784476 2.5009981 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.185126e-10 1.248944e-11 1.2982907e-10 ] [ 8.142926000000001e-11 1.4847812e-10 3.1843334e-10 ] [ 6.74986e-11 1.8132161e-10 -2.616097e-11 ] [ -2.826971e-11 2.7976234e-10 1.6123697e-10 ] [ 2.9551792e-10 1.3023563e-10 1.517452e-11 ] [ 3.0501498e-10 1.0784476e-10 2.5009981e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9e-07 4.2e-06 6.9e-06 ] [ -4.8e-06 -2.7e-06 -5.7e-06 ] [ 2.2e-06 8e-07 8.2e-06 ] [ 2.3e-06 -2.5e-06 -3.8e-06 ] [ -1.5e-06 1.1e-06 -5e-07 ] [ 2.8e-06 -1.1e-06 -5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.44195895872e-15 6.72914180736e-15 1.105501868352e-14 ] [ -7.69044777984e-15 -4.32587687616e-15 -9.13240673856e-15 ] [ 3.52478856576e-15 1.28174129664e-15 1.313784829056e-14 ] [ 3.68500622784e-15 -4.005441552e-15 -6.08827115904e-15 ] [ -2.4032649312e-15 1.76239428288e-15 -8.010883104e-16 ] [ 4.48609453824e-15 -1.76239428288e-15 -8.010883104e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.017216 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.72645856263037e-18 } }