{ "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" [ [ 3.5456511 -1.1177339 0.9828871 ] [ -0.2402147 -0.0849619 1.2353519 ] [ 2.4083987 -3.8019671 -2.9800115 ] [ -0.4089636 6.1073226 4.0882751 ] [ -3.7273498 -2.7663453 6.3436763 ] [ -2.9502397 5.3369206 -9.596875 ] [ 1.372718 -3.673235 -0.0733039 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.680759297933803e-09 -1.790807122855605e-09 1.574758732505912e-09 ] [ -3.848663763124858e-10 -1.361239698387475e-10 1.97925193264086e-09 ] [ 3.858680090705113e-09 -6.091422800670776e-09 -4.774504755015139e-09 ] [ -6.552319186782029e-10 9.78500948540347e-09 6.550138784618782e-09 ] [ -5.971872707103555e-09 -4.432173764719962e-09 1.016368985778305e-08 ] [ -4.726805073096006e-09 8.550689412385908e-09 -1.537588875774e-08 ] [ 2.199336686551335e-09 -5.885171239704288e-09 -1.174457947934611e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.286274 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.64804277179429e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9929919 1.1264499 1.9565678 ] [ 0.721611 2.3279689 3.2975641 ] [ 3.4437333 4.0491356 2.9348684 ] [ 3.9832005 0.2024787 2.1703068 ] [ 3.9559631 3.7110335 0.8198208 ] [ 4.556137 1.0025067 4.1401682 ] [ 3.7324481 2.946243 4.8145759 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9929919e-10 1.1264499e-10 1.9565678e-10 ] [ 7.21611e-11 2.3279689e-10 3.2975641e-10 ] [ 3.4437333e-10 4.0491356e-10 2.9348684e-10 ] [ 3.9832005e-10 2.024787e-11 2.1703068e-10 ] [ 3.9559631e-10 3.7110335e-10 8.198208000000001e-11 ] [ 4.556137e-10 1.0025067e-10 4.1401682e-10 ] [ 3.7324481e-10 2.946243e-10 4.8145759e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.4851722 0.2210371 0.1174556 ] [ 0.1196917 -0.2503443 -0.4579513 ] [ -0.0713345 0.4872435 -0.6726675 ] [ -0.1305174 -0.3085169 -0.3087473 ] [ -0.1362903 0.2135066 0.1467678 ] [ 0.0075726 0.9353593 1.0920387 ] [ 0.6960502 -1.2982853 0.083104 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.773315559021018e-10 3.541404739494317e-10 1.881846163020365e-10 ] [ 1.917672434438074e-10 -4.010957846105415e-10 -7.337188663249671e-10 ] [ -1.142904681564576e-10 7.806501443367648e-10 -1.077732142071984e-09 ] [ -2.091119268876019e-10 -4.942985643016915e-10 -4.946677057951239e-10 ] [ -2.183611323018182e-10 3.420752829064972e-10 2.351479378462502e-10 ] [ 1.213264267867008e-11 1.498610802507854e-09 1.749638874148825e-09 ] [ 1.115195357343164e-09 -2.080082354788315e-09 1.331472858949632e-10 ] ] } "relaxed-potential-energy" { "source-value" -14.950239 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.395292340117237e-18 } }