{ "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" [ [ 0.563951 0.9225225 1.195567 ] [ 1.348432 0.3073599 2.755625 ] [ 0.2422324 2.903648 2.041824 ] [ 2.040932 0.0344744 0.838059 ] [ 2.055265 2.344707 1.01543 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.63951e-11 9.225225000000001e-11 1.195567e-10 ] [ 1.348432e-10 3.073599e-11 2.755625000000001e-10 ] [ 2.422324e-11 2.903648e-10 2.041824e-10 ] [ 2.040932e-10 3.447440000000001e-12 8.38059e-11 ] [ 2.055265e-10 2.344707e-10 1.01543e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.7436811 -1.4080406 -2.0442831 ] [ -0.1745831 -0.5456449 5.2275538 ] [ -1.3093145 1.5194781 1.4892342 ] [ 3.4769492 -2.0388342 -3.302111 ] [ 3.7506295 2.4730416 -1.370394 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.202391651567416e-09 -2.25592974904334e-09 -3.275302616101085e-09 ] [ -2.797129635112853e-10 -8.742195092412665e-10 8.375464551337907e-09 ] [ -2.097753098457393e-09 2.434472307694715e-09 2.386016237793683e-09 ] [ 5.570686765844993e-09 -3.266572515840083e-09 -5.290565087074373e-09 ] [ 6.009170947691102e-09 3.962249466429974e-09 -2.195613246173796e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.151713 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.626483736367404e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1041919 0.9249567 0.8037891 ] [ 1.0573333 0.3688336 2.9853892 ] [ 0.6622432 2.6359101 2.4585347 ] [ 2.4110421 0.1579602 1.0628077 ] [ 2.0160019 2.4250512 0.5359843 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.041919e-11 9.249567e-11 8.037891e-11 ] [ 1.0573333e-10 3.688336e-11 2.9853892e-10 ] [ 6.622432e-11 2.6359101e-10 2.4585347e-10 ] [ 2.4110421e-10 1.579602e-11 1.0628077e-10 ] [ 2.0160019e-10 2.4250512e-10 5.359843e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.81e-05 -1.3e-05 6.7e-06 ] [ -3e-07 2.19e-05 -4.49e-05 ] [ 1.36e-05 3.6e-06 4.5e-06 ] [ 2.5e-05 -2.5e-05 1.73e-05 ] [ -1.01e-05 1.25e-05 1.64e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.50211634154e-14 -2.082829624199999e-14 1.07345834478e-14 ] [ -4.806529901999999e-16 3.50876682846e-14 -7.193773086659999e-14 ] [ 2.17896022224e-14 5.767835882399999e-15 7.209794853e-15 ] [ 4.005441585e-14 -4.005441585e-14 2.77176557682e-14 ] [ -1.61819840034e-14 2.0027207925e-14 2.62756967976e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971627206706e-18 } }