{ "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" [ [ -1.7736058 -2.5661952 0.5219574 ] [ -2.7927615 0.8237735 -5.820665 ] [ -2.3720595 1.9246746 7.3147659 ] [ 3.1527635 -1.9672634 -1.6348442 ] [ 3.7856632 1.7850104 -0.3812141 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.84162974727528e-09 -4.11149795384918e-09 8.36267943333554e-10 ] [ -4.47449718277034e-09 1.319830642534589e-09 -9.325733380508832e-09 ] [ -3.800458274046538e-09 3.083668646767592e-09 1.171954691160507e-08 ] [ 5.05128397061158e-09 -3.151903426435519e-09 -2.619309155890479e-09 ] [ 6.065301073262915e-09 2.859901930764856e-09 -6.107723185393132e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.6434354 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.06439568796751e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.201813 0.6182267 1.8052816 ] [ 0.9469364 1.4061273 -0.0280074 ] [ 1.2459311 1.743586 3.2584361 ] [ 3.2424078 0.6389892 0.2413113 ] [ 2.4551323 2.5784791 1.4858246 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.01813e-11 6.182267e-11 1.8052816e-10 ] [ 9.469364e-11 1.4061273e-10 -2.80074e-12 ] [ 1.2459311e-10 1.743586e-10 3.2584361e-10 ] [ 3.2424078e-10 6.389892e-11 2.413113e-11 ] [ 2.4551323e-10 2.5784791e-10 1.4858246e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6e-07 -1.8e-06 -1e-07 ] [ -8.7e-06 -1.2e-06 -8.1e-06 ] [ 1.9e-06 2.9e-06 -1e-07 ] [ 1.4e-06 2e-06 3e-06 ] [ 4.8e-06 -1.9e-06 5.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.6130597248e-16 -2.88391791744e-15 -1.6021766208e-16 ] [ -1.393893660096e-14 -1.92261194496e-15 -1.297763062848e-14 ] [ 3.04413557952e-15 4.646312200320001e-15 -1.6021766208e-16 ] [ 2.24304726912e-15 3.2043532416e-15 4.8065298624e-15 ] [ 7.69044777984e-15 -3.04413557952e-15 8.33131842816e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.457994 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.675555348726667e-18 } }