{ "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" [ [ 0.0780347 0.0112197 1.661349 ] [ 1.004167 1.583481 0.6099477 ] [ 1.186614 2.044688 2.371218 ] [ 2.525789 0.4216906 0.1723184 ] [ 2.89399 2.924329 1.948013 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.80347e-12 1.12197e-12 1.661349e-10 ] [ 1.004167e-10 1.583481e-10 6.099477e-11 ] [ 1.186614e-10 2.044688e-10 2.371218e-10 ] [ 2.525789e-10 4.216906e-11 1.723184e-11 ] [ 2.89399e-10 2.924329e-10 1.948013e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.3619693 -4.1081914 3.674447 ] [ -5.5569006 3.9744372 -17.8234012 ] [ -6.2857584 1.1055252 19.9718582 ] [ 8.7048868 -4.7037519 -3.6176078 ] [ 7.4997415 3.731981 -2.2052962 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.988645233107342e-09 -6.582048214851621e-09 5.887113077768698e-09 ] [ -8.903136225429493e-09 6.367750362677814e-09 -2.855623670577867e-08 ] [ -1.007089515247722e-08 1.771246629145244e-09 3.199844428197277e-08 ] [ 1.394676611767053e-08 -7.53624132422358e-09 -5.796046640383723e-09 ] [ 1.201591049334352e-08 5.979292707469805e-09 -3.533274013579081e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.7130164 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.551084689526981e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2852856 0.1550385 2.2526572 ] [ 0.6585757 1.1979423 0.1423987 ] [ 0.8649452 2.4656038 2.1788408 ] [ 2.7862932 0.6399037 -0.4212114 ] [ 3.0934951 2.52692 2.6101608 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.852856e-11 1.550385e-11 2.2526572e-10 ] [ 6.585757e-11 1.1979423e-10 1.423987e-11 ] [ 8.649452e-11 2.4656038e-10 2.1788408e-10 ] [ 2.7862932e-10 6.399037e-11 -4.212114e-11 ] [ 3.0934951e-10 2.52692e-10 2.6101608e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.19e-05 1e-07 -1.69e-05 ] [ -7.2e-06 -2.67e-05 9.8e-06 ] [ 1.04e-05 -6.1e-06 -8.5e-06 ] [ -5.3e-06 2.41e-05 1.71e-05 ] [ 2.4e-05 8.5e-06 -1.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.508766799552e-14 1.6021766208e-16 -2.707678489152e-14 ] [ -1.153567166976e-14 -4.277811577536e-14 1.570133088384e-14 ] [ 1.666263685632e-14 -9.77327738688e-15 -1.36185012768e-14 ] [ -8.491536090240001e-15 3.861245656128e-14 2.739722021568e-14 ] [ 3.84522388992e-14 1.36185012768e-14 -2.56348259328e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.996903 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.922115750860538e-18 } }