{ "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" [ [ 0.284773 1.136187 2.117179 ] [ 0.232979 2.36751 0.607179 ] [ 0.4870779 2.766051 2.845032 ] [ 1.778488 1.070505 1.035652 ] [ 2.177899 0.7799475 2.527686 ] [ 2.528264 2.860392 0.629956 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.84773e-11 1.136187e-10 2.117179e-10 ] [ 2.32979e-11 2.36751e-10 6.07179e-11 ] [ 4.870779e-11 2.766051e-10 2.845032e-10 ] [ 1.778488e-10 1.070505e-10 1.035652e-10 ] [ 2.177899e-10 7.799475000000001e-11 2.527686e-10 ] [ 2.528264e-10 2.860392e-10 6.29956e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -49.7478864 -33.0030635 23.1305519 ] [ -35.6894143 27.7024522 -40.4496725 ] [ -24.4432917 47.2500801 47.2937052 ] [ 32.7455996 -35.3978538 -61.9229911 ] [ 44.8222959 -37.8453881 56.5556999 ] [ 32.3126969 31.293773 -24.6072935 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.970490052429429e-08 -5.287673675447783e-08 3.705922948038102e-08 ] [ -5.71807452015052e-08 4.438422125366952e-08 -6.480751959851669e-08 ] [ -3.916247049713469e-08 7.570297366714732e-08 7.577286878244738e-08 ] [ 5.246423411319783e-08 -5.671361378485644e-08 -9.921156863042648e-08 ] [ 7.181323458155969e-08 -6.063499601892254e-08 9.06122201527609e-08 ] [ 5.177064752817664e-08 5.013815147722228e-08 -3.942523034686381e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 68.146208 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.091822612537739e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.0035508 1.5789921 2.3889348 ] [ 0.1444779 2.8527118 0.4166491 ] [ -0.1999214 3.0174771 4.2381792 ] [ 3.3473482 0.8223228 0.736726 ] [ 1.9826808 0.3235127 2.5863173 ] [ 2.2113446 2.3855759 -0.6041224 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.5508e-13 1.5789921e-10 2.3889348e-10 ] [ 1.444779e-11 2.8527118e-10 4.166491e-11 ] [ -1.999214e-11 3.0174771e-10 4.2381792e-10 ] [ 3.3473482e-10 8.223228000000001e-11 7.36726e-11 ] [ 1.9826808e-10 3.235127e-11 2.5863173e-10 ] [ 2.2113446e-10 2.3855759e-10 -6.041224e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.39e-05 -3.35e-05 -3.32e-05 ] [ 2.09e-05 2.49e-05 2.63e-05 ] [ -2.55e-05 2.2e-06 1.81e-05 ] [ -5.3e-06 1.72e-05 -3.97e-05 ] [ -3.05e-05 3.22e-05 2.48e-05 ] [ -3.4e-06 -4.3e-05 3.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.033555365312e-14 -5.36729167968e-14 -5.319226381056e-14 ] [ 3.348549137472e-14 3.989419785791999e-14 4.213724512704e-14 ] [ -4.08555038304e-14 3.52478856576e-15 2.899939683648e-14 ] [ -8.491536090240001e-15 2.755743787776e-14 -6.360641184576e-14 ] [ -4.88663869344e-14 5.159008718975999e-14 3.973398019584e-14 ] [ -5.44740051072e-15 -6.889359469439999e-14 6.08827115904e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.00141 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.083055513943533e-18 } }