{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.6554379e-10 2.354818e-10 2.6987169e-10 ] [ 2.543918e-10 2.0963319e-10 4.805077299999999e-10 ] [ 2.3044165e-10 4.5286568e-10 2.129679e-10 ] [ 3.8665755e-10 1.7522513e-10 1.860353e-10 ] [ 4.601965500000001e-10 2.604402e-10 3.9104417e-10 ] [ 3.727751e-10 3.6417204e-10 5.54794e-11 ] [ 4.0175246e-10 4.7795316e-10 3.6041131e-10 ] ] "source-value" [ [ 1.6554379 2.354818 2.6987169 ] [ 2.543918 2.0963319 4.8050773 ] [ 2.3044165 4.5286568 2.129679 ] [ 3.8665755 1.7522513 1.860353 ] [ 4.6019655 2.604402 3.9104417 ] [ 3.727751 3.6417204 0.554794 ] [ 4.0175246 4.7795316 3.6041131 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -8.0533407844512e-12 -3.777131383536e-12 -8.12575916771136e-12 ] [ -3.9637849598592e-13 3.5111700644832e-12 4.88375477552256e-12 ] [ 2.3744257520256e-12 3.96074082427968e-12 6.75269380368576e-12 ] [ -2.96274500718336e-12 -2.39541426575808e-12 -8.57164492128e-12 ] [ 1.246717715709312e-11 -2.0203447188288e-13 3.9469621053408e-12 ] [ 2.68701041074368e-12 -5.46326205926592e-12 -2.6612153671488e-13 ] [ -6.11598881457984e-12 4.365931291680001e-12 1.37995472349504e-12 ] ] "source-value" [ [ -0.0050265 -0.0023575 -0.0050717 ] [ -0.0002474 0.0021915 0.0030482 ] [ 0.001482 0.0024721 0.0042147 ] [ -0.0018492 -0.0014951 -0.00535 ] [ 0.0077814 -0.0001261 0.0024635 ] [ 0.0016771 -0.0034099 -0.0001661 ] [ -0.0038173 0.002725 0.0008613 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.281423404629712e-18 "source-value" -14.239525 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -8.936617390927337e-09 -1.041909075007517e-08 -6.90793462452857e-09 ] [ -2.763185257308967e-09 -5.397470118291727e-09 1.960741521509537e-08 ] [ -1.699015716571484e-08 1.57237592737016e-08 -6.769754260997025e-09 ] [ 5.663439608445294e-10 -6.401477302069288e-09 -6.244138591159204e-09 ] [ 1.45876748977941e-08 -8.890370082114957e-09 9.56322738558092e-09 ] [ 4.833453318988909e-09 1.707390277746639e-09 -1.578391075188226e-08 ] [ 8.702487796541266e-09 1.367725854088525e-08 6.535095627890768e-09 ] ] "source-value" [ [ -5.5777979 -6.503085 -4.3115937 ] [ -1.7246446 -3.3688359 12.2379861 ] [ -10.6044221 9.8139987 -4.2253483 ] [ 0.3534841 -3.9954879 -3.8972848 ] [ 9.1049106 -5.5489326 5.9688971 ] [ 3.0168043 1.0656692 -9.8515423 ] [ 5.4316657 8.5366734 4.0788859 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -8.416297395474247e-19 "source-value" -5.2530397 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.570546e-10 2.153895e-10 2.543093e-10 ] [ 2.524346e-10 2.661693e-10 4.212043000000001e-10 ] [ 2.241813e-10 4.238266e-10 2.673997e-10 ] [ 3.729345e-10 1.325386e-10 1.859362e-10 ] [ 4.629957e-10 2.667135e-10 3.458757e-10 ] [ 3.970969e-10 3.734581e-10 1.387215e-10 ] [ 4.050613e-10 4.976756e-10 3.428708e-10 ] ] "source-value" [ [ 1.570546 2.153895 2.543093 ] [ 2.524346 2.661693 4.212043 ] [ 2.241813 4.238266 2.673997 ] [ 3.729345 1.325386 1.859362 ] [ 4.629957 2.667135 3.458757 ] [ 3.970969 3.734581 1.387215 ] [ 4.050613 4.976756 3.428708 ] ] } "instance-id" 1 }