{ "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" [ [ 2.872342 2.592209 3.748836 ] [ 1.410068 4.838391 2.869154 ] [ 2.889421 3.430048 1.520903 ] [ 4.604684 2.417867 2.466033 ] [ 4.898299 2.012755 4.844446 ] [ 5.379024 4.52793 1.309626 ] [ 5.720081 4.239448 3.464417 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872342e-10 2.592209e-10 3.748836e-10 ] [ 1.410068e-10 4.838391e-10 2.869154e-10 ] [ 2.889421e-10 3.430048e-10 1.520903e-10 ] [ 4.604684e-10 2.417867e-10 2.466033e-10 ] [ 4.898299e-10 2.012755e-10 4.844446e-10 ] [ 5.379024e-10 4.52793e-10 1.309626e-10 ] [ 5.720081000000001e-10 4.239448000000001e-10 3.464417e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.9100598 2.5322934 2.300732 ] [ 2.0725067 -2.8944504 0.7128555 ] [ -0.991593 3.1390234 -2.0604089 ] [ 5.9946486 -2.9828627 -1.9946416 ] [ 0.847168 1.9671058 -0.7188602 ] [ -2.6464549 -0.3541051 -2.5675702 ] [ 0.6337844 -1.4070045 4.3278933 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.468959639089924e-09 4.057181282486142e-09 3.686179021126426e-09 ] [ 3.320521781191359e-09 -4.637420760945209e-09 1.142120416108694e-09 ] [ -1.588707121948934e-09 5.029269903624127e-09 -3.301138968868245e-09 ] [ 9.604485836831451e-09 -4.779072880996364e-09 -3.195768138395105e-09 ] [ 1.357312763489894e-09 3.15165092340008e-09 -1.151741006063612e-09 ] [ -4.240088168781603e-09 -5.67338912526046e-10 -4.11370094670278e-09 ] [ 1.015434548307756e-09 -2.254269715260394e-09 6.934049462576962e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.725637 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.839960119018745e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5812162 2.4481408 3.5993417 ] [ 1.5258822 4.5238161 3.1038907 ] [ 2.9204196 3.6479735 1.3846409 ] [ 4.750973 2.2624439 2.3727211 ] [ 4.6415041 2.6955245 4.8222888 ] [ 5.1605896 4.531646 1.4331259 ] [ 6.1933343 3.9491032 3.5074059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5812162e-10 2.4481408e-10 3.5993417e-10 ] [ 1.5258822e-10 4.5238161e-10 3.1038907e-10 ] [ 2.9204196e-10 3.6479735e-10 1.3846409e-10 ] [ 4.750973e-10 2.2624439e-10 2.3727211e-10 ] [ 4.6415041e-10 2.6955245e-10 4.8222888e-10 ] [ 5.1605896e-10 4.531646e-10 1.4331259e-10 ] [ 6.1933343e-10 3.9491032e-10 3.5074059e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.4e-06 -3.71e-05 -1.34e-05 ] [ 3.25e-05 3.07e-05 -3.9e-06 ] [ -1.89e-05 -8e-07 2.56e-05 ] [ -1.15e-05 -4.11e-05 -5e-06 ] [ -5.8e-06 3e-07 -2.56e-05 ] [ -5.3e-06 -5e-06 -1.25e-05 ] [ 1.53e-05 5.31e-05 3.47e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.025393037312e-14 -5.944075263168e-14 -2.146916671872e-14 ] [ 5.207074017599999e-14 4.918682225856e-14 -6.24848882112e-15 ] [ -3.028113813312e-14 -1.28174129664e-15 4.101572149248001e-14 ] [ -1.84250311392e-14 -6.584945911488e-14 -8.010883104e-15 ] [ -9.292624400640001e-15 4.8065298624e-16 -4.101572149248001e-14 ] [ -8.491536090240001e-15 -8.010883104e-15 -2.002720776e-14 ] [ 2.451330229824e-14 8.507557856448001e-14 5.559552874176001e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.913464 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.350706308074246e-18 } }