{ "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" [ [ 2.990348 2.100415 1.411886 ] [ 2.946969 3.752547 2.888488 ] [ 5.496135 2.06422 2.457996 ] [ 4.937229 4.674633 2.559339 ] [ 4.468449 3.37128 4.359326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.990348e-10 2.100415e-10 1.411886e-10 ] [ 2.946969e-10 3.752547e-10 2.888488e-10 ] [ 5.496135e-10 2.06422e-10 2.457996e-10 ] [ 4.937229e-10 4.674633e-10 2.559339e-10 ] [ 4.468449e-10 3.37128e-10 4.359326000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0514897 -0.8425848 -0.3470723 ] [ -9.3100651 -0.3697823 -1.9989505 ] [ 1.1268085 -2.4899705 -0.7021393 ] [ 6.0793157 7.6507038 -5.0686499 ] [ 2.0524512 -3.9483662 8.1168119 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.249559355200577e-11 -1.349969667601444e-09 -5.560711247872838e-10 ] [ -1.491636864134601e-08 -5.924565558456519e-10 -3.202671757236471e-09 ] [ 1.805346234818717e-09 -3.989372521581686e-09 -1.124951171004878e-09 ] [ 9.740137485002389e-09 1.225777876102572e-08 -8.120872368800257e-09 ] [ 3.288389327972905e-09 -6.325980015996938e-09 1.300456626161123e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.8921899 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.104250552389389e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1338038 1.9559663 1.4625127 ] [ 2.8531726 4.0278222 2.9919427 ] [ 5.482479 2.3574114 2.4789019 ] [ 5.0940708 4.8745617 2.0060733 ] [ 4.2756038 2.7473334 4.7376044 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1338038e-10 1.9559663e-10 1.4625127e-10 ] [ 2.853172600000001e-10 4.0278222e-10 2.9919427e-10 ] [ 5.482479e-10 2.3574114e-10 2.4789019e-10 ] [ 5.0940708e-10 4.8745617e-10 2.0060733e-10 ] [ 4.2756038e-10 2.7473334e-10 4.7376044e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.8e-06 2.09e-05 2.24e-05 ] [ 4.56e-05 -6.2e-06 -5.53e-05 ] [ -2.22e-05 -2.4e-06 -2.5e-06 ] [ -4.31e-05 -1.17e-05 3.16e-05 ] [ 1.59e-05 -6e-07 3.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.08827115904e-15 3.348549137472e-14 3.588875630592e-14 ] [ 7.305925390848e-14 -9.93349504896e-15 -8.860036713024e-14 ] [ -3.556832098176e-14 -3.84522388992e-15 -4.005441552e-15 ] [ -6.905381235648e-14 -1.874546646336e-14 5.062878121728e-14 ] [ 2.547460827072e-14 -9.6130597248e-16 6.08827115904e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.025254 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.926658081798169e-18 } }