{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.1837152 1.359189 0.2246076 ] [ 1.439885 0.3143995 0.1278355 ] [ 1.736921 1.45075 1.267781 ] [ 2.492617 0.9019618 2.872525 ] [ 2.597932 2.758406 2.155931 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.837152e-11 1.359189e-10 2.246076e-11 ] [ 1.439885e-10 3.143995e-11 1.278355e-11 ] [ 1.736921e-10 1.45075e-10 1.267781e-10 ] [ 2.492617e-10 9.019618e-11 2.872525e-10 ] [ 2.597932e-10 2.758406e-10 2.155931e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -23.1924889 11.6093294 -4.1575438 ] [ 11.1262013 -25.6990749 -15.5365514 ] [ 2.799311 8.624241 5.389056 ] [ 3.4001741 -9.289415 11.5054668 ] [ 5.8668024 14.7549196 2.7995724 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.715846349374351e-08 1.860019614784609e-08 -6.661119476311992e-09 ] [ 1.782613960117457e-08 -4.11744569809681e-08 -2.489229942093751e-08 ] [ 4.484990638548268e-09 1.381755730234481e-08 8.634219531381965e-09 ] [ 5.447679449669681e-09 -1.488328353390883e-08 1.843378991835059e-08 ] [ 9.39965364413333e-09 2.363998722490369e-08 4.485409447516947e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 11.836735 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.896454008360509e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.006962 1.7946663 0.0360489 ] [ 1.0059506 -0.3515548 0.1641972 ] [ 2.3285963 1.6231057 0.7415989 ] [ 3.0681905 0.7861302 2.9174962 ] [ 2.0552948 2.9323589 2.7893388 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.962000000000001e-13 1.7946663e-10 3.60489e-12 ] [ 1.0059506e-10 -3.515548e-11 1.641972e-11 ] [ 2.3285963e-10 1.6231057e-10 7.415989e-11 ] [ 3.0681905e-10 7.861302e-11 2.9174962e-10 ] [ 2.0552948e-10 2.9323589e-10 2.7893388e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.8e-06 -3e-06 5e-07 ] [ -2.9e-06 1.9e-06 -1.2e-06 ] [ -1.8e-06 3.2e-06 -2.3e-06 ] [ 6e-07 2.5e-06 4.3e-06 ] [ 1.4e-06 -4.7e-06 -1.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.48609453824e-15 -4.8065298624e-15 8.010883104e-16 ] [ -4.646312200320001e-15 3.04413557952e-15 -1.92261194496e-15 ] [ -2.88391791744e-15 5.126965186560001e-15 -3.68500622784e-15 ] [ 9.6130597248e-16 4.005441552e-15 6.889359469440001e-15 ] [ 2.24304726912e-15 -7.53023011776e-15 -2.24304726912e-15 ] ] } "relaxed-potential-energy" { "source-value" -7.1850018 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.151164190436592e-18 } }