{ "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" [ [ 1.305811 2.49596 1.153083 ] [ 2.737889 0.6120376 2.536176 ] [ 2.287817 4.454983 1.771215 ] [ 3.462438 1.614504 0.7986264 ] [ 3.194185 2.806829 3.238803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.305811e-10 2.49596e-10 1.153083e-10 ] [ 2.737889e-10 6.120375999999999e-11 2.536176e-10 ] [ 2.287817e-10 4.454983e-10 1.771215e-10 ] [ 3.462438e-10 1.614504e-10 7.986264e-11 ] [ 3.194185e-10 2.806829e-10 3.238803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0695739 -0.8301506 -0.0352804 ] [ -1.189598 -0.7452148 1.8284375 ] [ 0.4150271 -0.0511762 0.4187906 ] [ 0.8098738 1.4795201 -1.7040027 ] [ 0.0342711 0.1470216 -0.5079451 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.114696759978771e-10 -1.330047883063092e-09 -5.652543205247233e-11 ] [ -1.905946103750439e-09 -1.193965730034148e-09 2.929479815094e-09 ] [ 6.649467166184237e-10 -8.199331118138495e-11 6.709765083308045e-10 ] [ 1.297560868158455e-09 2.370452514223678e-09 -2.730113287720076e-09 ] [ 5.490835518909888e-11 2.355545702726093e-10 -8.138177638699182e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -4.8150477754089 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.714556973795189e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.1294444 2.1774 1.0707558 ] [ 2.3662807 0.8529101 2.5729749 ] [ 2.3641637 4.0718505 1.7243954 ] [ 3.5272994 2.134783 0.9031065 ] [ 3.6009517 2.74737 3.2266707 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1294444e-10 2.1774e-10 1.0707558e-10 ] [ 2.3662807e-10 8.529101e-11 2.5729749e-10 ] [ 2.3641637e-10 4.0718505e-10 1.7243954e-10 ] [ 3.5272994e-10 2.134783e-10 9.031065000000001e-11 ] [ 3.6009517e-10 2.74737e-10 3.2266707e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.64e-05 1.64e-05 -2.65e-05 ] [ 2.4e-06 -7.2e-06 1.58e-05 ] [ 5.3e-06 -3.61e-05 1.44e-05 ] [ 1.72e-05 5.3e-06 -1.15e-05 ] [ 1.14e-05 2.16e-05 7.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.831922899712e-14 2.627569658112e-14 -4.24576804512e-14 ] [ 3.84522388992e-15 -1.153567166976e-14 2.531439060864e-14 ] [ 8.491536090240001e-15 -5.783857601088001e-14 2.307134333952e-14 ] [ 2.755743787776e-14 8.491536090240001e-15 -1.84250311392e-14 ] [ 1.826481347712e-14 3.460701500928e-14 1.217654231808e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.786807775408899 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.271488126823796e-19 } }