{ "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" [ [ 1.302275 0.3737398 2.647818 ] [ 0.2826825 1.480501 1.727575 ] [ 0.6414777 2.53008 2.452953 ] [ 2.763361 0.4669357 0.177905 ] [ 2.062003 2.101671 0.3497139 ] [ 2.601995 2.989286 1.853157 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.302275e-10 3.737398e-11 2.647818e-10 ] [ 2.826825e-11 1.480501e-10 1.727575e-10 ] [ 6.414777000000001e-11 2.53008e-10 2.452953e-10 ] [ 2.763361e-10 4.669357e-11 1.77905e-11 ] [ 2.062003e-10 2.101671e-10 3.497139e-11 ] [ 2.601995e-10 2.989286e-10 1.853157e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 149.403811 -156.0492645 129.2837052 ] [ -3766.1024885 -10440.1880183 -7462.9742698 ] [ 3617.8111102 10597.6312618 7327.094153 ] [ 79.5856593 -189.6181702 -16.3304195 ] [ -130.8592229 118.3092862 -95.6221284 ] [ 50.1611309 69.9149049 118.5489595 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.393712930426218e-07 -2.500184832749354e-07 2.071353299218394e-07 ] [ -6.033961358611402e-06 -1.672702515967654e-05 -1.195700289670551e-05 ] [ 5.796372379232932e-06 1.697927704351516e-05 1.173929895033698e-05 ] [ 1.275102826814141e-07 -3.038017991733153e-07 -2.616421633075643e-08 ] [ -2.09659587546436e-07 1.895523723731761e-07 -1.532035385536157e-07 ] [ 8.036699120086848e-08 1.120160260762354e-07 1.899363713310661e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 1447.9366 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.319850168920642e-16 } "relaxed-configuration-positions" { "source-value" [ [ 1.7201667 0.7283345 2.7868079 ] [ 0.3020618 0.9173754 1.1022538 ] [ 0.7593351 2.6732307 2.3641369 ] [ 2.4585976 0.6408386 0.7055736 ] [ 1.4977629 2.5857368 0.2828992 ] [ 2.9158702 2.3966975 1.9674505 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7201667e-10 7.283345e-11 2.7868079e-10 ] [ 3.020618e-11 9.173754e-11 1.1022538e-10 ] [ 7.593351000000001e-11 2.6732307e-10 2.3641369e-10 ] [ 2.4585976e-10 6.408386e-11 7.055736e-11 ] [ 1.4977629e-10 2.5857368e-10 2.828992e-11 ] [ 2.9158702e-10 2.3966975e-10 1.9674505e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.81e-05 8.22e-05 -8.08e-05 ] [ 4.59e-05 -3.6e-06 7.08e-05 ] [ 3.6e-06 2.51e-05 -9.66e-05 ] [ -6.19e-05 0.0001024 -5.7e-05 ] [ 6.43e-05 -0.0001036 0.0001176 ] [ -0.00011 -0.0001026 4.59e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.308646166848001e-14 1.3169891822976e-13 -1.2945587096064e-13 ] [ 7.353990689472e-14 -5.76783583488e-15 1.1343410475264e-13 ] [ 5.76783583488e-15 4.021463318208e-14 -1.5477026156928e-13 ] [ -9.917473282752e-14 1.6406288596992e-13 -9.13240673856e-14 ] [ 1.0301995671744e-13 -1.6598549791488e-13 1.8841597060608e-13 ] [ -1.76239428288e-13 -1.6438332129408e-13 7.353990689472e-14 ] ] } "relaxed-potential-energy" { "source-value" -40.305538 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.457659067236599e-18 } }