{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.55675 2.192965 3.527099 ] [ 1.806278 5.26626 2.450306 ] [ 0.8031725 3.384297 2.630387 ] [ 2.570894 3.149532 1.167105 ] [ 2.627788 4.286276 4.286712 ] [ 4.842075 2.861339 2.293967 ] [ 3.90768 5.002934 2.246314 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.55675e-10 2.192965e-10 3.527099e-10 ] [ 1.806278e-10 5.26626e-10 2.450306e-10 ] [ 8.031725e-11 3.384297e-10 2.630387e-10 ] [ 2.570894e-10 3.149532e-10 1.167105e-10 ] [ 2.627788e-10 4.286276e-10 4.286712e-10 ] [ 4.842075000000001e-10 2.861339e-10 2.293967e-10 ] [ 3.90768e-10 5.002934e-10 2.246314e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8332646 5.36778 -6.3417667 ] [ -2.2951417 1.3838487 -0.6597264 ] [ 4.6280659 -4.9886516 1.7999051 ] [ 2.1351653 4.4142471 10.9596566 ] [ -0.0756848 -0.8205552 -7.4001202 ] [ -8.3178778 3.2067403 0.3585372 ] [ 3.0922085 -8.5634093 1.2835144 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.335037061060264e-09 8.600131621597825e-09 -1.016063034130797e-08 ] [ -3.677222373163167e-09 2.217170033864473e-09 -1.056998214204549e-09 ] [ 7.414978984501711e-09 -7.992700962836514e-09 2.883765870878686e-09 ] [ 3.420911925203419e-09 7.0724035020542e-09 1.755930557651642e-08 ] [ -1.212604171099238e-10 -1.314674357515868e-09 -1.185629957554982e-08 ] [ -1.332670934583134e-08 5.137764337637178e-09 5.744399195270937e-10 ] [ 4.954264165339036e-09 -1.372009417480129e-08 2.05641676414014e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -38.606569 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.185454226110204e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5728921 1.9312228 3.2040348 ] [ 1.7547555 5.3103552 2.2808325 ] [ 0.8963348 3.36585 2.9325423 ] [ 2.632382 3.4147156 1.5729248 ] [ 2.8289429 4.0548857 3.7418994 ] [ 4.4674834 2.9890782 2.720116 ] [ 3.9618468 5.0774955 2.1495401 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5728921e-10 1.9312228e-10 3.2040348e-10 ] [ 1.7547555e-10 5.310355200000001e-10 2.2808325e-10 ] [ 8.963348e-11 3.36585e-10 2.9325423e-10 ] [ 2.632382e-10 3.4147156e-10 1.5729248e-10 ] [ 2.8289429e-10 4.0548857e-10 3.7418994e-10 ] [ 4.4674834e-10 2.9890782e-10 2.720116e-10 ] [ 3.9618468e-10 5.077495500000001e-10 2.1495401e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.97e-05 -1.65e-05 -3.07e-05 ] [ -7.1e-06 -4.9e-06 -7.88e-05 ] [ -5.48e-05 1.92e-05 -2.63e-05 ] [ -2.48e-05 -5.14e-05 8.19e-05 ] [ 6.77e-05 2.37e-05 5.23e-05 ] [ -1.98e-05 -8.6e-06 -6.04e-05 ] [ 9.1e-06 3.85e-05 6.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.758464563776e-14 -2.64359142432e-14 -4.918682225856e-14 ] [ -1.137545400768e-14 -7.850665441919999e-15 -1.2625151771904e-13 ] [ -8.779927881984e-14 3.076179111936e-14 -4.213724512704e-14 ] [ -3.973398019584e-14 -8.235187830912e-14 1.3121826524352e-13 ] [ 1.0846735722816e-13 3.797158591296e-14 8.379383726784e-14 ] [ -3.172309709184e-14 -1.377871893888e-14 -9.677146789632e-14 ] [ 1.457980724928e-14 6.16837999008e-14 9.917473282752e-14 ] ] } "relaxed-potential-energy" { "source-value" -52.328123 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.383889528094676e-18 } }