{ "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" [ [ 0.5485971 0.5343947 2.664941 ] [ 1.37313 2.35631 1.443365 ] [ 2.145447 0.6526892 0.5854964 ] [ 2.929696 0.0722677 2.986283 ] [ 2.995983 2.738917 0.2990299 ] [ 2.823077 2.78342 2.858653 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.485971e-11 5.343947e-11 2.664941e-10 ] [ 1.37313e-10 2.35631e-10 1.443365e-10 ] [ 2.145447e-10 6.526892e-11 5.854964e-11 ] [ 2.929696e-10 7.22677e-12 2.986283e-10 ] [ 2.995983e-10 2.738917e-10 2.990299e-11 ] [ 2.823077e-10 2.78342e-10 2.858653e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.742496 -0.4438039 -0.5973066 ] [ -11.358371 3.7817108 3.1935731 ] [ 1.4656099 -5.6721828 1.1205491 ] [ -1.7631592 3.6010785 -2.2092491 ] [ 6.5488174 1.7092199 -2.9389956 ] [ 2.3646069 -2.9760225 1.4314291 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.393962973837517e-09 -7.11052232799861e-10 -9.569906699695373e-10 ] [ -1.819811646657272e-08 6.058968630386864e-09 5.116668157635781e-09 ] [ 2.348165916993026e-09 -9.087838671063882e-09 1.795317570478481e-09 ] [ -2.824892448988432e-09 5.769563782365533e-09 -3.539607257543441e-09 ] [ 1.049236213216824e-08 2.738472163586114e-09 -4.708790038954069e-09 ] [ 3.788517892562364e-09 -4.768113672474768e-09 2.293402238352785e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.559708 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.813375362567473e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.803496 0.7908489 2.7801772 ] [ 0.8340604 2.6012813 1.1720183 ] [ 2.2899552 0.6603721 0.8380905 ] [ 3.0488315 -0.0869689 3.0060131 ] [ 3.0990294 2.886498 0.364755 ] [ 2.7405577 2.2859672 2.6767143 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.03496e-11 7.908489e-11 2.7801772e-10 ] [ 8.340604e-11 2.6012813e-10 1.1720183e-10 ] [ 2.2899552e-10 6.603721e-11 8.380905e-11 ] [ 3.0488315e-10 -8.696890000000001e-12 3.0060131e-10 ] [ 3.0990294e-10 2.886498e-10 3.64755e-11 ] [ 2.7405577e-10 2.2859672e-10 2.6767143e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.36e-05 4.75e-05 -4.73e-05 ] [ 4.3e-06 -1.31e-05 9.9e-06 ] [ -3e-06 -0.0 6.98e-05 ] [ -1.14e-05 -2.39e-05 1.86e-05 ] [ -1.65e-05 4.93e-05 -2.24e-05 ] [ -2.69e-05 -5.98e-05 -2.87e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.587666687488e-14 7.610338948800001e-14 -7.578295416384e-14 ] [ 6.889359469440001e-15 -2.098851373248e-14 1.586154854592e-14 ] [ -4.8065298624e-15 0.0 1.1183192813184e-13 ] [ -1.826481347712e-14 -3.829202123712e-14 2.980048514688e-14 ] [ -2.64359142432e-14 7.898730740544e-14 -3.588875630592e-14 ] [ -4.309855109952001e-14 -9.581016192383999e-14 -4.598246901696e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.902638 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.829624777904567e-18 } }