{ "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" [ [ 1.26846 0.3454837 2.901552 ] [ 0.267977 2.35609 2.023372 ] [ 2.685563 0.3914351 1.602855 ] [ 2.683655 1.904541 0.876934 ] [ 1.547568 2.030572 0.3165864 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26846e-10 3.454837e-11 2.901552e-10 ] [ 2.67977e-11 2.35609e-10 2.023372e-10 ] [ 2.685563e-10 3.914351e-11 1.602855e-10 ] [ 2.683655e-10 1.904541e-10 8.769340000000001e-11 ] [ 1.547568e-10 2.030572e-10 3.165864e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.0111443 -0.1746781 7.5770843 ] [ -2.8828817 0.1143451 2.556923 ] [ 9.558758 -29.2596604 7.8652493 ] [ 99.8650732 15.5813384 34.382329 ] [ -98.5298052 13.738655 -52.3815856 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.283526820906228e-08 -2.798651702915154e-10 1.213982741930825e-08 ] [ -4.618885698326197e-09 1.832010474323934e-10 4.096642285537181e-09 ] [ 1.531481871766057e-08 -4.687914421165509e-08 1.260151864904486e-08 ] [ 1.600014868337396e-07 2.496405631092694e-08 5.508656414630058e-08 ] [ -1.578621516440117e-07 2.201175202358727e-08 -8.392455250019086e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 32.256554 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.168069711215923e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0415952 0.3438677 3.0794598 ] [ -0.1458169 2.0014142 1.9660121 ] [ 3.1259717 0.1536331 2.0713136 ] [ 3.2267737 1.6936055 0.334795 ] [ 1.2046994 2.8356014 0.269719 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0415952e-10 3.438677e-11 3.0794598e-10 ] [ -1.458169e-11 2.0014142e-10 1.9660121e-10 ] [ 3.1259717e-10 1.536331e-11 2.0713136e-10 ] [ 3.2267737e-10 1.6936055e-10 3.34795e-11 ] [ 1.2046994e-10 2.8356014e-10 2.69719e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3e-07 4e-07 -3e-07 ] [ 2e-07 4e-07 2.3e-06 ] [ -1.5e-06 -1.8e-06 -5e-07 ] [ 1e-07 3.5e-06 1.2e-06 ] [ 9e-07 -2.5e-06 -2.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.806529901999999e-16 6.408706536e-16 -4.806529901999999e-16 ] [ 3.204353268e-16 6.408706536e-16 3.685006258199999e-15 ] [ -2.403264951e-15 -2.8839179412e-15 -8.010883169999999e-16 ] [ 1.602176634e-16 5.607618218999999e-15 1.9226119608e-15 ] [ 1.4419589706e-15 -4.005441585e-15 -4.3258769118e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.435336 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.992360477513902e-18 } }