{ "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" [ [ 2.586158 0.6938923 0.8841089 ] [ 2.34485 2.26041 2.433738 ] [ 3.767171 2.568287 0.2210666 ] [ 4.342877 1.484782 1.999902 ] [ 4.214846 3.620834 1.934125 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.586158e-10 6.938923e-11 8.841089e-11 ] [ 2.34485e-10 2.26041e-10 2.433738e-10 ] [ 3.767171e-10 2.568287e-10 2.210666e-11 ] [ 4.342877e-10 1.484782e-10 1.999902e-10 ] [ 4.214846e-10 3.620834e-10 1.934125e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.7180863 -7.677438 -4.7820227 ] [ -8.7450844 4.1425937 5.8449558 ] [ -1.8071398 1.5970179 -14.9362628 ] [ 11.6767261 -10.7472456 7.0587146 ] [ 3.5935844 12.685072 6.8146151 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.559207564776775e-09 -1.230061167124151e-08 -7.661644970074892e-09 ] [ -1.40111697726028e-08 6.637166775613369e-09 9.36465153236936e-09 ] [ -2.895357138077188e-09 2.558704742379112e-09 -2.393053106028475e-08 ] [ 1.870817756490516e-08 -1.721898563831567e-08 1.130930750501963e-08 ] [ 5.757556910551596e-09 2.03237257915647e-08 1.091821699297065e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.1345165 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.419872433011843e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.3713715 0.8395423 0.7495537 ] [ 2.2469172 2.2181615 2.8788965 ] [ 4.0849274 2.4571835 -0.1976185 ] [ 4.5922044 1.2775204 2.1103816 ] [ 3.9604816 3.8357975 1.9317273 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3713715e-10 8.395423e-11 7.495537000000001e-11 ] [ 2.2469172e-10 2.2181615e-10 2.8788965e-10 ] [ 4.0849274e-10 2.4571835e-10 -1.976185e-11 ] [ 4.5922044e-10 1.2775204e-10 2.1103816e-10 ] [ 3.9604816e-10 3.8357975e-10 1.9317273e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.13e-05 -8.8e-06 -4e-07 ] [ 2.7e-06 -5.1e-06 3.7e-06 ] [ 1.17e-05 -2.2e-06 3e-07 ] [ -4.1e-06 2.5e-06 -6.2e-06 ] [ 1.1e-06 1.36e-05 2.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.810459581504e-14 -1.409915426304e-14 -6.408706483200001e-16 ] [ 4.32587687616e-15 -8.17110076608e-15 5.928053496960001e-15 ] [ 1.874546646336e-14 -3.52478856576e-15 4.8065298624e-16 ] [ -6.568924145279999e-15 4.005441552e-15 -9.93349504896e-15 ] [ 1.76239428288e-15 2.178960204288e-14 4.16565921408e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.338031 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.656335157330565e-18 } }