{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.915912 1.360436 2.810198 ] [ 1.265862 2.897087 3.881297 ] [ 2.470833 3.120785 1.738737 ] [ 4.740838 1.736953 1.131717 ] [ 4.024671 3.068015 3.686077 ] [ 4.392743 4.331921 1.580851 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.915912e-10 1.360436e-10 2.810198e-10 ] [ 1.265862e-10 2.897087e-10 3.881297e-10 ] [ 2.470833e-10 3.120785e-10 1.738737e-10 ] [ 4.740838000000001e-10 1.736953e-10 1.131717e-10 ] [ 4.024671e-10 3.068015e-10 3.686077e-10 ] [ 4.392743000000001e-10 4.331921e-10 1.580851e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4917274 -2.9263708 0.3017713 ] [ 0.2888912 0.0493685 -0.3508888 ] [ -2.548187 1.8980926 -1.6853339 ] [ 0.0074436 -0.0300555 -0.4416385 ] [ 1.0736883 1.8333036 1.6656465 ] [ 0.6864365 -0.8243385 0.5104434 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.878341505775715e-10 -4.688562918179887e-09 4.834909256718042e-10 ] [ 4.628547304082208e-10 7.9097057155629e-11 -5.621858364922991e-10 ] [ -4.082645670462557e-09 3.041079612888308e-09 -2.700202595068092e-09 ] [ 1.19259619928424e-11 -4.8154219823187e-11 -7.075828853748089e-10 ] [ 1.720238306459182e-09 2.937276190948082e-09 2.668659902803881e-09 ] [ 1.099792521024741e-09 -1.320735883206609e-09 8.178204884595155e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -13.267923719227609 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.125755736464085e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1571906 1.1146998 2.5301451 ] [ 1.7264043 3.5744119 3.7810022 ] [ 1.9715531 2.9721357 1.5285874 ] [ 4.877216 1.9306542 1.1619578 ] [ 3.9585797 2.8842833 3.9741933 ] [ 4.1199152 4.0390121 1.8529912 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1571906e-10 1.1146998e-10 2.5301451e-10 ] [ 1.7264043e-10 3.5744119e-10 3.7810022e-10 ] [ 1.9715531e-10 2.9721357e-10 1.5285874e-10 ] [ 4.877216e-10 1.9306542e-10 1.1619578e-10 ] [ 3.9585797e-10 2.8842833e-10 3.9741933e-10 ] [ 4.1199152e-10 4.0390121e-10 1.8529912e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.3e-06 -9.9e-06 9.1e-06 ] [ 8e-07 -1.4e-06 -4e-07 ] [ -2.7e-06 -6e-07 -9.9e-06 ] [ 3e-06 -3.7e-06 -7.5e-06 ] [ 5.4e-06 2e-07 5.3e-06 ] [ 8e-07 1.54e-05 3.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.16958894282e-14 -1.58615486766e-14 1.45798073694e-14 ] [ 1.2817413072e-15 -2.2430472876e-15 -6.408706536e-16 ] [ -4.3258769118e-15 -9.613059803999998e-16 -1.58615486766e-14 ] [ 4.806529901999999e-15 -5.9280535458e-15 -1.2016324755e-14 ] [ 8.6517538236e-15 3.204353268e-16 8.4915361602e-15 ] [ 1.2817413072e-15 2.46735201636e-14 5.4474005556e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.647189719227608 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.667173838991149e-18 } }