{ "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" [ [ 1.899847 1.906187 1.523281 ] [ 1.884769 1.70171 3.709853 ] [ 2.49478 3.91064 2.644859 ] [ 3.453021 0.2240813 2.013003 ] [ 4.505277 2.817941 2.046258 ] [ 4.372743 1.259433 3.808578 ] [ 3.775648 3.545824 4.38804 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.899847e-10 1.906187e-10 1.523281e-10 ] [ 1.884769e-10 1.70171e-10 3.709853e-10 ] [ 2.49478e-10 3.91064e-10 2.644859e-10 ] [ 3.453021e-10 2.240813e-11 2.013003e-10 ] [ 4.505277e-10 2.817941e-10 2.046258e-10 ] [ 4.372743e-10 1.259433e-10 3.808578e-10 ] [ 3.775648e-10 3.545824e-10 4.38804e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8902684 -0.5313424 -2.7028363 ] [ -1.6386492 -1.044075 3.2663639 ] [ -1.4958268 2.8183647 -1.4763738 ] [ 0.3565982 -1.3596699 -1.3782568 ] [ 1.9192705 0.151402 -2.3292553 ] [ 0.8690207 -0.9088571 1.4977612 ] [ 0.879855 0.8741778 3.1225971 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.426367216717023e-09 -8.513043709197618e-10 -4.330421129709576e-09 ] [ -2.625405437932623e-09 -1.67279255536176e-09 5.23329187560511e-09 ] [ -2.396578727726077e-09 4.515518031228006e-09 -2.365411585921655e-09 ] [ 5.713332990593625e-10 -2.178431325785474e-09 -2.208210822418622e-09 ] [ 3.075010324091127e-09 2.425727447423616e-10 -3.73187838553449e-09 ] [ 1.39232464853125e-09 -1.456149597268088e-09 2.399677978181353e-09 ] [ 1.409683110693984e-09 1.400587233582378e-09 5.00295206979788e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.561152 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.012518406471516e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6487204 1.9527773 1.9620341 ] [ 1.8869013 1.4805131 4.1828447 ] [ 2.9269492 3.8499559 2.1813662 ] [ 3.5146089 0.6781467 1.6371645 ] [ 4.8433858 2.6503509 1.8651681 ] [ 4.3498374 1.3013567 3.8944448 ] [ 3.2156821 3.4527156 4.4108496 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6487204e-10 1.9527773e-10 1.9620341e-10 ] [ 1.8869013e-10 1.4805131e-10 4.1828447e-10 ] [ 2.9269492e-10 3.8499559e-10 2.1813662e-10 ] [ 3.5146089e-10 6.781467e-11 1.6371645e-10 ] [ 4.8433858e-10 2.6503509e-10 1.8651681e-10 ] [ 4.3498374e-10 1.3013567e-10 3.8944448e-10 ] [ 3.2156821e-10 3.4527156e-10 4.4108496e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4e-07 3e-07 4e-07 ] [ 3.3e-06 -1.1e-06 -1e-07 ] [ -6e-07 5e-07 -1.1e-06 ] [ -4.2e-06 -5.6e-06 -2.6e-06 ] [ 2.6e-06 2.3e-06 5.3e-06 ] [ -4.1e-06 7.3e-06 -9e-07 ] [ 2.5e-06 -3.8e-06 -1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.408706483200001e-16 4.8065298624e-16 6.408706483200001e-16 ] [ 5.28718284864e-15 -1.76239428288e-15 -1.6021766208e-16 ] [ -9.6130597248e-16 8.010883104e-16 -1.76239428288e-15 ] [ -6.72914180736e-15 -8.972189076479999e-15 -4.16565921408e-15 ] [ 4.16565921408e-15 3.68500622784e-15 8.491536090240001e-15 ] [ -6.568924145279999e-15 1.169588933184e-14 -1.44195895872e-15 ] [ 4.005441552e-15 -6.08827115904e-15 -1.6021766208e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.445632 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.314445386308035e-18 } }