{ "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" [ [ 2.272226 1.517825 2.823083 ] [ 2.079314 3.025232 4.309487 ] [ 1.624731 3.89644 2.167347 ] [ 4.204366 1.580563 1.938725 ] [ 4.130904 2.338344 4.256427 ] [ 3.588528 3.628489 1.149971 ] [ 3.881136 4.134812 3.114475 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.272226e-10 1.517825e-10 2.823083e-10 ] [ 2.079314e-10 3.025232e-10 4.309487e-10 ] [ 1.624731e-10 3.89644e-10 2.167347e-10 ] [ 4.204366000000001e-10 1.580563e-10 1.938725e-10 ] [ 4.130904e-10 2.338344e-10 4.256427000000001e-10 ] [ 3.588528e-10 3.628489e-10 1.149971e-10 ] [ 3.881136e-10 4.134812e-10 3.114475e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.1498838 -6.7797833 -3.0738679 ] [ -7.0350394 4.0412021 7.7177025 ] [ -6.2247886 1.908592 -1.9474354 ] [ 5.4440591 -5.774642 -5.050654 ] [ 7.7960965 -4.6909687 5.4871682 ] [ 1.9258472 -0.738575 -9.6630072 ] [ 4.2437091 12.034175 6.5300938 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.853200126175126e-09 -1.086241038684341e-08 -4.924879325382649e-09 ] [ -1.127137574594938e-08 6.47471957789173e-09 1.236512261366338e-08 ] [ -9.973210846509572e-09 3.057901506239328e-09 -3.120135494104444e-09 ] [ 8.722344284135067e-09 -9.251996482115026e-09 -8.092039825218634e-09 ] [ 1.249072364870918e-08 -7.515760441965355e-09 8.791412676867838e-09 ] [ 3.085547384494324e-09 -1.18332760745655e-09 -1.548184435001376e-08 ] [ 6.79917156151317e-09 1.928087399446694e-08 1.046236370418827e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -9.6859853 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.551865932492748e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.725383 1.3381803 2.5654465 ] [ 2.1233685 2.926145 4.5160415 ] [ 1.5751156 3.8309909 2.0672966 ] [ 4.0996501 1.3948187 2.0547973 ] [ 4.5964374 2.402437 4.2086382 ] [ 3.8822239 3.5811884 1.0186349 ] [ 3.7790265 4.6479446 3.3286599 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.725383e-10 1.3381803e-10 2.5654465e-10 ] [ 2.1233685e-10 2.926145e-10 4.5160415e-10 ] [ 1.5751156e-10 3.8309909e-10 2.0672966e-10 ] [ 4.0996501e-10 1.3948187e-10 2.0547973e-10 ] [ 4.5964374e-10 2.402437e-10 4.2086382e-10 ] [ 3.8822239e-10 3.5811884e-10 1.0186349e-10 ] [ 3.7790265e-10 4.6479446e-10 3.3286599e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6e-06 1.56e-05 1.07e-05 ] [ -3.3e-06 -1.91e-05 -9e-07 ] [ 3e-07 -9.2e-06 -1.23e-05 ] [ 8e-06 -1e-06 2.1e-06 ] [ -4e-06 -2.7e-06 -1e-06 ] [ -9e-06 4.9e-06 6.7e-06 ] [ 1.4e-05 1.15e-05 -5.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.613059803999999e-15 2.49939554904e-14 1.71432899838e-14 ] [ -5.2871828922e-15 -3.06015737094e-14 -1.4419589706e-15 ] [ 4.806529901999999e-16 -1.47400250328e-14 -1.97067725982e-14 ] [ 1.2817413072e-14 -1.602176634e-15 3.364570931399999e-15 ] [ -6.408706535999999e-15 -4.3258769118e-15 -1.602176634e-15 ] [ -1.4419589706e-14 7.850665506599998e-15 1.07345834478e-14 ] [ 2.243047287599999e-14 1.8425031291e-14 -8.331318496799998e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.482183 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.800954511391202e-18 } }