{ "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" [ [ 2.246807 1.041122 2.124463 ] [ 1.267764 1.326115 3.99765 ] [ 2.011294 2.700157 5.439591 ] [ 2.31677 3.176049 2.822929 ] [ 4.533635 0.1687206 2.857812 ] [ 4.258439 2.493804 2.204153 ] [ 4.092776 1.731475 4.602458 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.246807e-10 1.041122e-10 2.124463e-10 ] [ 1.267764e-10 1.326115e-10 3.99765e-10 ] [ 2.011294e-10 2.700157e-10 5.439591000000001e-10 ] [ 2.31677e-10 3.176049e-10 2.822929e-10 ] [ 4.533635000000001e-10 1.687206e-11 2.857812e-10 ] [ 4.258439e-10 2.493804e-10 2.204153e-10 ] [ 4.092776e-10 1.731475e-10 4.602458e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.6090874 -9.4720262 -6.7860169 ] [ -9.3012327 -9.8024575 6.7448131 ] [ 0.4781577 3.2764288 0.1035379 ] [ 1.4077855 14.5654486 1.1470731 ] [ 1.7572886 -6.3640156 -1.2552495 ] [ 7.1083955 6.3849882 -4.7963957 ] [ 1.1586926 1.4116336 4.842238 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.180218833903858e-09 -1.517585892924507e-08 -1.087239762553369e-08 ] [ -1.490221757656046e-08 -1.570526823288561e-08 1.080638186048557e-08 ] [ 7.660930879955003e-10 5.249417623075799e-09 1.658860027467283e-10 ] [ 2.255521015201238e-09 2.333642121838409e-08 1.837813703168581e-09 ] [ 2.815486710918363e-09 -1.019627700872649e-08 -2.011131402170889e-09 ] [ 1.138890508149993e-08 1.022987881812387e-08 -7.68467305464565e-09 ] [ 1.856430194413966e-09 2.261686351055739e-09 7.75812051594935e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.774273 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.168187789391668e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3451355 0.9585501 1.9676491 ] [ 0.7826693 1.2408166 3.86169 ] [ 2.3533611 2.6039545 5.2685354 ] [ 1.9859118 3.3041369 2.862592 ] [ 4.4026476 0.0759966 3.014616 ] [ 4.2709371 2.5688836 2.3280052 ] [ 4.5868226 1.8851043 4.7459683 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3451355e-10 9.585501e-11 1.9676491e-10 ] [ 7.826693e-11 1.2408166e-10 3.86169e-10 ] [ 2.3533611e-10 2.6039545e-10 5.2685354e-10 ] [ 1.9859118e-10 3.3041369e-10 2.862592e-10 ] [ 4.4026476e-10 7.59966e-12 3.014616e-10 ] [ 4.270937100000001e-10 2.5688836e-10 2.3280052e-10 ] [ 4.5868226e-10 1.8851043e-10 4.7459683e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.92e-05 4.95e-05 -1.04e-05 ] [ 2.9e-05 1e-06 -4.4e-06 ] [ 5.56e-05 -4.43e-05 -5.78e-05 ] [ -9.8e-06 -4.56e-05 5.25e-05 ] [ -6.04e-05 -3.58e-05 2.48e-05 ] [ 1.93e-05 -7.5e-06 6e-06 ] [ -5.3e-05 8.28e-05 -1.06e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.076179111936e-14 7.930774272959999e-14 -1.666263685632e-14 ] [ 4.64631220032e-14 1.6021766208e-15 -7.04957713152e-15 ] [ 8.908102011648e-14 -7.097642430144e-14 -9.260580868224001e-14 ] [ -1.570133088384e-14 -7.305925390848e-14 8.4114272592e-14 ] [ -9.677146789632e-14 -5.735792302464001e-14 3.973398019584e-14 ] [ 3.092200878144e-14 -1.2016324656e-14 9.6130597248e-15 ] [ -8.49153609024e-14 1.3266022420224e-13 -1.698307218048e-14 ] ] } "relaxed-potential-energy" { "source-value" -25.348563 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.061287500947591e-18 } }