{ "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" [ [ 0.1501776 0.7389508 1.254214 ] [ 0.5251994 1.126951 2.894489 ] [ 1.795844 1.050789 0.3566565 ] [ 2.560887 2.159455 0.963327 ] [ 1.607121 2.890729 1.590789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.501776e-11 7.389508e-11 1.254214e-10 ] [ 5.251994e-11 1.126951e-10 2.894489e-10 ] [ 1.795844e-10 1.050789e-10 3.566565e-11 ] [ 2.560887e-10 2.159455e-10 9.633270000000001e-11 ] [ 1.607121e-10 2.890729e-10 1.590789e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -21.4006166 -12.5217835 4.7264039 ] [ -11.2816183 -8.8962983 15.9055129 ] [ 60.2088117 57.3794805 17.2676202 ] [ -197.2444945 63.6522638 65.8323576 ] [ 169.7179176 -99.6136625 -103.7318946 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.428756758722438e-08 -2.00621087744192e-08 7.572533829037942e-09 ] [ -1.807514508504944e-08 -1.425344114792278e-08 2.548344091021281e-08 ] [ 9.64651504718895e-08 9.19320621707495e-08 2.766577738129382e-08 ] [ -3.160205176694142e-07 1.019821689213542e-07 1.054750642388652e-07 ] [ 2.719180797095809e-07 -1.595986811697617e-07 -1.661968163594098e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 203.15068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.254832699956221e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.0937776 0.705971 1.2665812 ] [ 0.4955482 1.1036315 2.9363877 ] [ 1.9556914 1.2059846 0.4046661 ] [ 2.0471059 2.4756438 1.2259203 ] [ 2.0471059 2.4756438 1.2259203 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.37776e-12 7.05971e-11 1.2665812e-10 ] [ 4.955482e-11 1.1036315e-10 2.9363877e-10 ] [ 1.9556914e-10 1.2059846e-10 4.046661e-11 ] [ 2.0471059e-10 2.4756438e-10 1.2259203e-10 ] [ 2.0471059e-10 2.4756438e-10 1.2259203e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -25.1271755 -15.272545 1.2457931 ] [ -11.025766 -7.1009528 19.8320768 ] [ 22.6108638 108.9931115 57.3882323 ] [ 6.7710389 -43.3098069 1.103965237842873e+111 ] [ 6.7710389 -43.3098069 -1.103965237842873e+111 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.025817313283855e-08 -2.446931453911594e-08 1.995980579173956e-09 ] [ -1.766522451161153e-08 -1.13769805615643e-08 3.177448979087007e-08 ] [ 3.622659735645305e-08 1.746262150735476e-07 9.194608410009941e-08 ] [ 1.084840022410735e-08 -6.938996006654253e-08 1.768747294247763e+102 ] [ 1.084840022410735e-08 -6.938996006654253e-08 -1.768747294247763e+102 ] ] } "relaxed-potential-energy" { "source-value" -8.1709842e+94 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.309135985416619e+76 } }