{ "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" [ [ 2.147227 2.362862 2.450911 ] [ 2.622761 1.752099 4.557796 ] [ 1.686581 4.667086 2.204349 ] [ 1.229897 3.438837 4.460251 ] [ 4.850673 1.640741 2.950795 ] [ 3.668046 3.670667 2.833872 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.147227e-10 2.362862e-10 2.450911e-10 ] [ 2.622761e-10 1.752099e-10 4.557796e-10 ] [ 1.686581e-10 4.667086e-10 2.204349e-10 ] [ 1.229897e-10 3.438837e-10 4.460251000000001e-10 ] [ 4.850672999999999e-10 1.640741e-10 2.950795e-10 ] [ 3.668046e-10 3.670667e-10 2.833872e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.3070972 -33.3561018 -16.6738505 ] [ 6.1332175 -9.3119614 4.1535985 ] [ -7.6509185 15.291892 -3.2565897 ] [ -11.2956 12.3115212 10.6289464 ] [ 2.4397272 -3.7761771 0.7153438 ] [ 23.6806709 18.840827 4.4325515 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.132032002455314e-08 -5.34423664649848e-08 -2.671445344981439e-08 ] [ 9.826497688781424e-09 -1.491940684887204e-08 6.654798408889949e-09 ] [ -1.22581227483462e-08 2.450031185019856e-08 -5.217631880878086e-09 ] [ -1.809754623790848e-08 1.972523143312356e-08 1.702944942581633e-08 ] [ 3.908873880969846e-09 -6.050102665620344e-09 1.146107112194231e-09 ] [ 3.79406172808389e-08 3.01863325359374e-08 7.101730383791971e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.6748214 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.069424279509553e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7051719 2.2337509 2.1136488 ] [ 2.6357231 1.2849008 4.3688263 ] [ 1.9868231 4.8997278 2.7543816 ] [ 1.0352441 3.3165228 4.5582625 ] [ 4.8689794 2.2871788 3.8295094 ] [ 3.9732434 3.5102109 1.8333453 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7051719e-10 2.2337509e-10 2.1136488e-10 ] [ 2.6357231e-10 1.2849008e-10 4.3688263e-10 ] [ 1.9868231e-10 4.8997278e-10 2.7543816e-10 ] [ 1.0352441e-10 3.3165228e-10 4.5582625e-10 ] [ 4.8689794e-10 2.2871788e-10 3.8295094e-10 ] [ 3.9732434e-10 3.5102109e-10 1.8333453e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.36e-05 -2.33e-05 -2.51e-05 ] [ 4.61e-05 -3.15e-05 -1.17e-05 ] [ 4.92e-05 5.02e-05 -2.55e-05 ] [ -1.11e-05 -1.69e-05 4.39e-05 ] [ -3.2e-05 6.1e-06 7.19e-05 ] [ -1.86e-05 1.52e-05 -5.35e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.383313445888e-14 -3.733071526464e-14 -4.021463318208e-14 ] [ 7.386034221888001e-14 -5.04685635552e-14 -1.874546646336e-14 ] [ 7.882708974336e-14 8.042926636416e-14 -4.08555038304e-14 ] [ -1.778416049088e-14 -2.707678489152e-14 7.033555365312e-14 ] [ -5.12696518656e-14 9.77327738688e-15 1.1519649903552e-13 ] [ -2.980048514688e-14 2.435308463616e-14 -8.57164492128e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.684471 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.15379992290156e-18 } }