{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.107976 2.819188 1.252407 ] [ 2.630591 3.411672 3.024039 ] [ 3.968262 4.362454 1.692316 ] [ 3.394725 3.292047 0.1208017 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.107976e-10 2.819188e-10 1.252407e-10 ] [ 2.630591e-10 3.411672e-10 3.024039e-10 ] [ 3.968262e-10 4.362454e-10 1.692316e-10 ] [ 3.394725e-10 3.292047e-10 1.208017e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1087358 -0.6041884 -2.6691969 ] [ -23.5703941 -16.6173949 27.3266989 ] [ 58.7806536 80.149414 67.7283469 ] [ -35.3189953 -62.9278307 -92.3858489 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.742139566039846e-10 -9.680165290385587e-10 -4.276524869491836e-09 ] [ -3.776393437006226e-08 -2.662400160738116e-08 4.378219810122108e-08 ] [ 9.417698895326335e-08 1.284135172816202e-07 1.085127739686122e-07 ] [ -5.658726853980508e-08 -1.008214991452005e-07 -1.480184472003414e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 10.479511 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.679002752161643e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2497138 2.5806709 1.2262289 ] [ 2.3792898 3.5698871 3.2665074 ] [ 4.3009239 4.3622637 1.8185079 ] [ 3.1716266 3.3725393 -0.2216805 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2497138e-10 2.5806709e-10 1.2262289e-10 ] [ 2.3792898e-10 3.5698871e-10 3.2665074e-10 ] [ 4.3009239e-10 4.3622637e-10 1.8185079e-10 ] [ 3.1716266e-10 3.3725393e-10 -2.216805e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.4e-05 -4.21e-05 -3.69e-05 ] [ -3.6e-06 5.96e-05 4.14e-05 ] [ 1e-05 -4.55e-05 1.69e-05 ] [ -4.05e-05 2.8e-05 -2.14e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.44740051072e-14 -6.745163573568001e-14 -5.912031730752001e-14 ] [ -5.76783583488e-15 9.548972659968001e-14 6.633011210111999e-14 ] [ 1.6021766208e-14 -7.28990362464e-14 2.707678489152e-14 ] [ -6.488815314240001e-14 4.48609453824e-14 -3.428657968511999e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.481807 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.999805936073779e-18 } }