{ "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" [ [ 2.024908 1.18877 2.927879 ] [ 1.938594 2.418534 4.826435 ] [ 2.412467 3.694527 2.059811 ] [ 3.090256 4.25078 4.272664 ] [ 3.913894 1.726388 1.808826 ] [ 4.03064 2.069757 3.989682 ] [ 4.599294 3.851686 2.39416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.024908e-10 1.18877e-10 2.927879e-10 ] [ 1.938594e-10 2.418534e-10 4.826435e-10 ] [ 2.412467e-10 3.694527e-10 2.059811e-10 ] [ 3.090256e-10 4.25078e-10 4.272664e-10 ] [ 3.913894e-10 1.726388e-10 1.808826e-10 ] [ 4.03064e-10 2.069757e-10 3.989682e-10 ] [ 4.599294e-10 3.851686e-10 2.39416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.139945 -1.4721353 -2.803537 ] [ -5.2451542 -0.3539087 4.0453624 ] [ -4.3868358 -1.335789 -0.9977764 ] [ -0.2894493 6.0604806 2.7854709 ] [ 1.882431 -3.671596 -5.5016166 ] [ 6.9998432 -2.8448697 3.8352868 ] [ 5.1791101 3.6178181 -1.36319 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.632923145045129e-09 -2.35862077974658e-09 -4.491761473954457e-09 ] [ -8.403663500966962e-09 -5.670242497093158e-10 6.481385113342161e-09 ] [ -7.028485815954696e-09 -2.140169923754226e-09 -1.598614034036638e-09 ] [ -4.637489051876562e-10 9.7099604081303e-09 4.46281639066695e-09 ] [ 3.015986963317253e-09 -5.882545320687863e-09 -8.814561565746524e-09 ] [ 1.121498521670379e-08 -4.557983760114589e-09 6.14480689564863e-09 ] [ 8.297849187133402e-09 5.796383625882275e-09 -2.18407116570246e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.623103 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.46440303811753e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0817022 0.9879516 2.9001304 ] [ 1.6969151 2.6262555 4.6593995 ] [ 2.171943 3.4758297 2.2875856 ] [ 3.3123488 4.4257916 4.3780243 ] [ 3.9349578 1.77495 1.5314771 ] [ 4.1166447 2.0100119 4.0779737 ] [ 4.6955415 3.8996517 2.4448665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0817022e-10 9.879516000000001e-11 2.9001304e-10 ] [ 1.6969151e-10 2.6262555e-10 4.6593995e-10 ] [ 2.171943e-10 3.4758297e-10 2.2875856e-10 ] [ 3.3123488e-10 4.4257916e-10 4.3780243e-10 ] [ 3.9349578e-10 1.77495e-10 1.5314771e-10 ] [ 4.1166447e-10 2.0100119e-10 4.0779737e-10 ] [ 4.6955415e-10 3.8996517e-10 2.4448665e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5e-06 -3.04e-05 3.6e-06 ] [ -3.3e-06 1.1e-05 -2.54e-05 ] [ -2.08e-05 3.3e-06 -1.26e-05 ] [ 3.3e-05 1.19e-05 1.62e-05 ] [ -9.8e-06 -8.7e-06 -2.2e-06 ] [ -1e-07 -1.46e-05 1.22e-05 ] [ -3.9e-06 2.75e-05 8.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.010883169999999e-15 -4.870616967359999e-14 5.767835882399999e-15 ] [ -5.2871828922e-15 1.7623942974e-14 -4.06952865036e-14 ] [ -3.332527398719999e-14 5.2871828922e-15 -2.01874255884e-14 ] [ 5.287182892199999e-14 1.90659019446e-14 2.59552614708e-14 ] [ -1.57013310132e-14 -1.39389367158e-14 -3.5247885948e-15 ] [ -1.602176634e-16 -2.33917788564e-14 1.95465549348e-14 ] [ -6.248488872599999e-15 4.4059857435e-14 1.31378483988e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.557231 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.254937497194045e-18 } }