{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7607129 0.1029019 2.480933 ] [ 0.9158836 2.552597 0.2381701 ] [ 0.8989231 2.268448 2.632769 ] [ 2.109562 0.2713555 0.0459784 ] [ 2.969591 1.985029 0.1686784 ] [ 2.973458 2.362165 2.304699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.607129000000001e-11 1.029019e-11 2.480933e-10 ] [ 9.158836e-11 2.552597e-10 2.381701e-11 ] [ 8.989231e-11 2.268448e-10 2.632769e-10 ] [ 2.109562e-10 2.713555e-11 4.59784e-12 ] [ 2.969591e-10 1.985029e-10 1.686784e-11 ] [ 2.973458e-10 2.362165e-10 2.304699e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.680012 -2.5553098 0.3594758 ] [ -4.1938242 2.1695716 0.1882882 ] [ -4.2238235 1.757163 0.5072713 ] [ -3.9546775 -10.2390334 -1.2707383 ] [ 8.0632751 7.5771026 -1.9936816 ] [ 4.9890621 1.290506 2.2093846 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.089499337239608e-09 -4.094057654191213e-09 5.759437272484572e-10 ] [ -6.719247140343742e-09 3.476036923309994e-09 3.016709544979188e-10 ] [ -6.767311317840099e-09 2.815285500729342e-09 8.127382239588041e-10 ] [ -6.336091885505534e-09 -1.640474006822558e-08 -2.035947212188882e-09 ] [ 1.291879095873401e-08 1.213985673914065e-08 -3.194230075155734e-09 ] [ 7.99335872219497e-09 2.067618559236804e-09 3.539824381639436e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.0929041 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.45684384842228e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.5383403 1.0361885 4.1689713 ] [ 0.5224988 2.258413 0.3153925 ] [ 0.8307277 2.1079513 2.6707008 ] [ 3.8076896 0.5375034 -1.6120916 ] [ 2.8486571 1.876421 -0.0135283 ] [ 3.1568977 1.7260193 2.3417832 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.383403e-11 1.0361885e-10 4.1689713e-10 ] [ 5.224988000000001e-11 2.258413e-10 3.153925e-11 ] [ 8.307277e-11 2.1079513e-10 2.6707008e-10 ] [ 3.8076896e-10 5.375034e-11 -1.6120916e-10 ] [ 2.8486571e-10 1.876421e-10 -1.35283e-12 ] [ 3.1568977e-10 1.7260193e-10 2.3417832e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.95e-05 -5.5e-06 1.11e-05 ] [ -2.33e-05 2e-06 8.1e-06 ] [ 4.58e-05 2.14e-05 -2.48e-05 ] [ 1.58e-05 2.77e-05 -5.7e-06 ] [ -1.14e-05 -4.71e-05 2.8e-06 ] [ -7.4e-06 1.6e-06 8.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.1242444363e-14 -8.811971486999999e-15 1.77841606374e-14 ] [ -3.733071557219999e-14 3.204353268e-15 1.29776307354e-14 ] [ 7.33796898372e-14 3.42865799676e-14 -3.97339805232e-14 ] [ 2.53143908172e-14 4.438029276179999e-14 -9.1324068138e-15 ] [ -1.82648136276e-14 -7.546251946139999e-14 4.486094575199999e-15 ] [ -1.18561070916e-14 2.5634826144e-15 1.3618501389e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.969384 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.238142063617345e-18 } }