{ "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" [ [ 1.500338 2.7906 1.855645 ] [ 0.2759319 4.819421 1.912518 ] [ 2.741561 4.698408 2.586297 ] [ 3.692301 2.569506 2.304209 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.500338e-10 2.7906e-10 1.855645e-10 ] [ 2.759319e-11 4.819421e-10 1.912518e-10 ] [ 2.741561e-10 4.698407999999999e-10 2.586297e-10 ] [ 3.692301e-10 2.569506e-10 2.304209e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -68.1239514 -87.0341913 -33.4240736 ] [ -15.744779 32.7813378 1.8285701 ] [ 27.1997803 75.0606076 23.7914575 ] [ 56.6689501 -20.8077542 7.804046 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.091466022495954e-07 -1.394441465110948e-07 -5.355126929381849e-08 ] [ -2.52259168134628e-08 5.252149302170731e-08 2.929692263713918e-09 ] [ 4.357885208755641e-08 1.202603506397628e-07 3.811811698125681e-08 ] [ 9.079366697550183e-08 -3.333769731059301e-08 1.250346004884776e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 37.573055 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.019867029303254e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0141457 2.0618952 1.5461182 ] [ 0.3540391 4.8542232 1.9751347 ] [ 3.0909087 5.3770626 2.7832666 ] [ 3.7510384 2.584754 2.3541495 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0141457e-10 2.0618952e-10 1.5461182e-10 ] [ 3.540391e-11 4.8542232e-10 1.9751347e-10 ] [ 3.0909087e-10 5.377062600000001e-10 2.7832666e-10 ] [ 3.7510384e-10 2.584754000000001e-10 2.3541495e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.01e-05 1.64e-05 -1.57e-05 ] [ -2.9e-06 -7.2e-06 1.43e-05 ] [ -9e-07 -2.51e-05 -2.22e-05 ] [ 1.39e-05 1.6e-05 2.36e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.618198387008e-14 2.627569658112e-14 -2.515417294656e-14 ] [ -4.646312200320001e-15 -1.153567166976e-14 2.291112567744e-14 ] [ -1.44195895872e-15 -4.021463318208e-14 -3.556832098176e-14 ] [ 2.227025502912e-14 2.56348259328e-14 3.781136825088e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.3275482 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.494437965542512e-18 } }