{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0299584 0.6173503 0.5342358 ] [ 0.7975385 2.616511 1.362514 ] [ 1.80202 0.5667157 2.620782 ] [ 2.455492 1.646275 1.01187 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.99584e-12 6.173503e-11 5.342358000000001e-11 ] [ 7.975385000000001e-11 2.616511e-10 1.362514e-10 ] [ 1.80202e-10 5.667157e-11 2.620782e-10 ] [ 2.455492e-10 1.646275e-10 1.01187e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.0068491 -9.0665026 -0.8891231 ] [ -111.9711964 78.3465789 22.7773284 ] [ -21.3660623 -42.0568807 54.5387504 ] [ 138.3441078 -27.2231955 -76.4269558 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.02185657189352e-09 -1.452613849814241e-08 -1.424532243833221e-09 ] [ -1.793976330750851e-07 1.255250570332426e-07 3.649330304676386e-08 ] [ -3.423220549561628e-08 -6.738255100131474e-08 8.738071081852665e-08 ] [ 2.216516951425949e-07 -4.361636737356777e-08 -1.22449481781675e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 21.886726 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.50664007030555e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.6889031 0.4297368 1.1151599 ] [ 0.7672295 2.5785123 0.9562406 ] [ 1.6997624 0.2800087 2.1323556 ] [ 3.3069201 2.1585942 1.3256456 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.889031e-11 4.297368e-11 1.1151599e-10 ] [ 7.672295e-11 2.5785123e-10 9.562406e-11 ] [ 1.6997624e-10 2.800087e-11 2.1323556e-10 ] [ 3.3069201e-10 2.1585942e-10 1.3256456e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.9e-06 -1.05e-05 1.07e-05 ] [ 3.5e-06 1.33e-05 -7.7e-06 ] [ -1.13e-05 -5.9e-06 -7.6e-06 ] [ 4.8e-06 3.1e-06 4.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.646312200320001e-15 -1.68228545184e-14 1.714328984256e-14 ] [ 5.6076181728e-15 2.130894905664e-14 -1.233675998016e-14 ] [ -1.810459581504e-14 -9.45284206272e-15 -1.217654231808e-14 ] [ 7.69044777984e-15 4.96674752448e-15 7.370012455680001e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.675149 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03078273929565e-18 } }