{ "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" [ [ 0.0450915 0.6744384 2.108849 ] [ 0.1091138 2.224666 0.3426204 ] [ 1.10319 2.788623 2.698849 ] [ 2.780637 1.123883 1.270131 ] [ 2.821139 0.9081744 2.973557 ] [ 2.438974 2.484533 0.05951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.50915e-12 6.744384e-11 2.108849e-10 ] [ 1.091138e-11 2.224666e-10 3.426204e-11 ] [ 1.10319e-10 2.788623e-10 2.698849e-10 ] [ 2.780637e-10 1.123883e-10 1.270131e-10 ] [ 2.821139e-10 9.081744000000001e-11 2.973557e-10 ] [ 2.438974e-10 2.484533e-10 5.951e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.203004 0.9181895 0.2213961 ] [ 0.2873022 0.0478582 0.9775738 ] [ 0.2273547 -1.8480704 -1.3385344 ] [ 1.093983 -5.8086564 -7.8289888 ] [ -0.9734284 -0.8153808 13.9443429 ] [ -1.8382155 7.5060599 -5.9757897 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.927424883528883e-09 1.471101750364042e-09 3.547156553562989e-10 ] [ 4.603088679444057e-10 7.667728915357056e-11 1.566245887466615e-09 ] [ 3.642623849689978e-10 -2.960935188472504e-09 -2.144568521816555e-09 ] [ 1.752753986152646e-09 -9.306493482340294e-09 -1.254342281986505e-08 ] [ -1.559604224502751e-09 -1.306384054809201e-09 2.234130018679847e-08 ] [ -2.945145898092182e-09 1.202603368610439e-08 -9.574270548157447e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.9843969304906786 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.577177747619448e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.4936124 0.6306121 2.3159317 ] [ 0.4190396 1.9833747 0.3713053 ] [ 0.905579 2.9591044 2.4756714 ] [ 2.1938006 0.4423358 0.6755021 ] [ 2.6803427 1.4180631 2.7798672 ] [ 2.605771 2.7708277 0.8352387 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.936124e-11 6.306121e-11 2.3159317e-10 ] [ 4.190396e-11 1.9833747e-10 3.713053e-11 ] [ 9.055790000000001e-11 2.9591044e-10 2.4756714e-10 ] [ 2.1938006e-10 4.423358e-11 6.755021000000001e-11 ] [ 2.680342700000001e-10 1.4180631e-10 2.7798672e-10 ] [ 2.605771e-10 2.7708277e-10 8.352387e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.45e-05 -3.27e-05 4.22e-05 ] [ -1.34e-05 2.38e-05 -1.41e-05 ] [ 1.97e-05 -8.7e-06 -1.39e-05 ] [ 2.77e-05 -1.87e-05 -2.03e-05 ] [ 2.9e-06 1.67e-05 2.7e-06 ] [ 7.5e-06 1.97e-05 3.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.129685962560001e-14 -5.239117550016001e-14 6.761185339776e-14 ] [ -2.146916671872e-14 3.813180357504e-14 -2.259069035328e-14 ] [ 3.156287942976e-14 -1.393893660096e-14 -2.227025502912e-14 ] [ 4.438029239616e-14 -2.996070280896e-14 -3.252418540224e-14 ] [ 4.646312200320001e-15 2.675634956736e-14 4.32587687616e-15 ] [ 1.2016324656e-14 3.156287942976e-14 5.44740051072e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.32264193049068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.333434232432195e-18 } }