{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2869528 0.4871961 1.041667 ] [ 1.49337 1.111154 0.3370846 ] [ 0.208303 2.963803 0.6319363 ] [ 0.9157171 2.598087 2.560793 ] [ 2.236963 2.266905 1.430037 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.869528e-11 4.871961e-11 1.041667e-10 ] [ 1.49337e-10 1.111154e-10 3.370846e-11 ] [ 2.08303e-11 2.963803e-10 6.319363e-11 ] [ 9.157170999999999e-11 2.598087e-10 2.560793e-10 ] [ 2.236963e-10 2.266905e-10 1.430037e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -33.0683858 -20.722794 17.6873576 ] [ 26.4502509 -1.2834577 -32.8159975 ] [ -9.0079143 8.3935278 -7.4172399 ] [ -11.190045 4.5697458 20.0480168 ] [ 26.8160942 9.042978 2.4978629 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.298139461635471e-08 -3.320157606445451e-08 2.83382708304492e-08 ] [ 4.237797360627416e-08 -2.05632592072574e-09 -5.257702398273126e-08 ] [ -1.443226969363e-08 1.344791400719486e-08 -1.188372835864493e-08 ] [ -1.792842848469994e-08 7.321539883758993e-09 3.212046381036563e-08 ] [ 4.296411918841048e-08 1.448844793400874e-08 4.002017540343688e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 6.4315102 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.030441527887673e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3712703 0.5831685 1.5631248 ] [ 1.6303842 1.1003886 -0.5271013 ] [ 0.2541925 2.9352384 0.4533898 ] [ 0.4261462 2.6704676 2.9277125 ] [ 2.4593128 2.1378821 1.5843922 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.712703e-11 5.831685e-11 1.5631248e-10 ] [ 1.6303842e-10 1.1003886e-10 -5.271013e-11 ] [ 2.541925e-11 2.9352384e-10 4.533898e-11 ] [ 4.261462e-11 2.6704676e-10 2.927712500000001e-10 ] [ 2.4593128e-10 2.1378821e-10 1.5843922e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.01e-05 -2.32e-05 1.45e-05 ] [ -1e-05 8.5e-06 -1.5e-06 ] [ 1.56e-05 1.29e-05 5.5e-06 ] [ -3.3e-06 3.6e-06 -1.97e-05 ] [ -1.24e-05 -1.8e-06 1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.618198387008e-14 -3.717049760256e-14 2.32315610016e-14 ] [ -1.6021766208e-14 1.36185012768e-14 -2.4032649312e-15 ] [ 2.499395528448e-14 2.066807840832e-14 8.8119714144e-15 ] [ -5.28718284864e-15 5.76783583488e-15 -3.156287942976e-14 ] [ -1.986699009792e-14 -2.88391791744e-15 1.92261194496e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.840953 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.538000454779163e-18 } }