{ "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" [ [ 1.111705 1.964485 2.063826 ] [ 1.996516 4.229048 2.317605 ] [ 3.494235 2.652341 1.536538 ] [ 4.5932 4.863032 2.072185 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.111705e-10 1.964485e-10 2.063826e-10 ] [ 1.996516e-10 4.229048e-10 2.317605e-10 ] [ 3.494235e-10 2.652341e-10 1.536538e-10 ] [ 4.593200000000001e-10 4.863032e-10 2.072185e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5068896 -1.4711285 0.1445047 ] [ -2.0836939 3.6096526 1.3407306 ] [ 3.2600833 -2.4870516 -1.5828604 ] [ 0.3305002 0.3485275 0.0976251 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.414303287246664e-09 -2.357007688892573e-09 2.315220519357178e-10 ] [ -3.338445651483573e-09 5.783301004929934e-09 2.148087222111157e-09 ] [ 5.223229245120512e-09 -3.984695928243233e-09 -2.536021926870137e-09 ] [ 5.295196936097242e-10 5.584026122058719e-10 1.564126528232621e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.5632688 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.051551582738607e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5200754 2.3244103 1.9857425 ] [ 1.7587325 4.6272918 2.5716736 ] [ 3.8390966 2.2271599 1.4234082 ] [ 4.0777515 4.530044 2.0093298 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5200754e-10 2.3244103e-10 1.9857425e-10 ] [ 1.7587325e-10 4.6272918e-10 2.5716736e-10 ] [ 3.8390966e-10 2.2271599e-10 1.4234082e-10 ] [ 4.0777515e-10 4.530044e-10 2.0093298e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.2e-06 8e-07 2.2e-06 ] [ -4.4e-06 6.8e-06 -1e-07 ] [ 2.9e-06 -5.2e-06 -5.1e-06 ] [ -2.7e-06 -2.3e-06 3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.72914180736e-15 1.28174129664e-15 3.52478856576e-15 ] [ -7.04957713152e-15 1.089480102144e-14 -1.6021766208e-16 ] [ 4.646312200320001e-15 -8.33131842816e-15 -8.17110076608e-15 ] [ -4.32587687616e-15 -3.68500622784e-15 4.8065298624e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.6918948 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.392595063901309e-18 } }