{ "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" [ [ 0.5834212 0.4864796 1.920549 ] [ 1.105833 1.594471 0.5913636 ] [ 0.1509893 2.698828 2.704799 ] [ 2.461816 0.3168887 1.8618 ] [ 2.990224 2.253685 0.1987983 ] [ 2.155559 1.839196 2.850141 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.834212e-11 4.864796e-11 1.920549e-10 ] [ 1.105833e-10 1.594471e-10 5.913636000000001e-11 ] [ 1.509893e-11 2.698828e-10 2.704799e-10 ] [ 2.461816e-10 3.168887e-11 1.8618e-10 ] [ 2.990224e-10 2.253685e-10 1.987983e-11 ] [ 2.155559e-10 1.839196e-10 2.850141e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -16.0728597 -10.3490991 11.191253 ] [ -4.9677589 9.9548687 -12.5717598 ] [ -2.5060144 0.9170172 -0.9752554 ] [ 14.9725427 -12.6155695 -7.1837977 ] [ 5.4446347 0.1784449 2.3186929 ] [ 3.1294556 11.9143377 7.2208671 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.57515600407385e-08 -1.658108462436232e-08 1.793036391405786e-08 ] [ -7.959227167351125e-09 1.594945789427369e-08 -2.014217963387328e-08 ] [ -4.01507768306814e-09 1.469223518711478e-09 -1.562531401188952e-09 ] [ 2.398865786786971e-08 -2.021237051097754e-08 -1.150971272349681e-08 ] [ 8.723266425136421e-09 2.859002468809939e-10 3.714955555194952e-09 ] [ 5.013940598151637e-09 1.908887331525605e-08 1.15691044495239e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -12.088232 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.936748269720643e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4693864 0.3496894 2.4888676 ] [ 0.9706817 1.7648617 0.55386 ] [ -0.1095099 2.7008208 2.5010328 ] [ 2.568503 0.071379 1.313701 ] [ 3.3381091 2.2437169 0.570911 ] [ 2.2106722 2.0590804 2.6990785 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.693864e-11 3.496894e-11 2.4888676e-10 ] [ 9.706817e-11 1.7648617e-10 5.538600000000001e-11 ] [ -1.095099e-11 2.7008208e-10 2.5010328e-10 ] [ 2.568503e-10 7.1379e-12 1.313701e-10 ] [ 3.3381091e-10 2.2437169e-10 5.70911e-11 ] [ 2.2106722e-10 2.0590804e-10 2.6990785e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.25e-05 -1.1e-05 8.1e-06 ] [ -1.1e-06 2.16e-05 8.6e-06 ] [ -9.2e-06 2.2e-06 -1.82e-05 ] [ -1.99e-05 -2.12e-05 9.1e-06 ] [ 1.05e-05 1.58e-05 -1.39e-05 ] [ -2.7e-06 -7.4e-06 6.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.604897396800001e-14 -1.76239428288e-14 1.297763062848e-14 ] [ -1.76239428288e-15 3.460701500928e-14 1.377871893888e-14 ] [ -1.474002491136e-14 3.52478856576e-15 -2.915961449856e-14 ] [ -3.188331475392e-14 -3.396614436096001e-14 1.457980724928e-14 ] [ 1.68228545184e-14 2.531439060864e-14 -2.227025502912e-14 ] [ -4.32587687616e-15 -1.185610699392e-14 1.009371271104e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.902638 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.829624777904567e-18 } }