{ "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" [ [ 1.931726 1.779285 1.793394 ] [ 2.022352 0.7174538 3.630998 ] [ 4.124201 0.9725878 2.711634 ] [ 3.467636 2.844975 3.645464 ] [ 5.471294 3.704408 2.165903 ] [ 3.262896 3.451778 1.529715 ] [ 3.831227 5.45457 3.339943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.931726e-10 1.779285e-10 1.793394e-10 ] [ 2.022352e-10 7.174538e-11 3.630998e-10 ] [ 4.124201e-10 9.725878e-11 2.711634e-10 ] [ 3.467636e-10 2.844975e-10 3.645464e-10 ] [ 5.471294000000001e-10 3.704408e-10 2.165903e-10 ] [ 3.262896e-10 3.451778e-10 1.529715e-10 ] [ 3.831227000000001e-10 5.454570000000001e-10 3.339943e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.2093248 0.7553111 -10.3667863 ] [ -2.6350424 -4.7617124 0.3505065 ] [ 7.0317399 -5.9484058 1.8149317 ] [ 4.6296654 9.7994583 11.837894 ] [ 5.4197617 -0.5714464 -2.9651762 ] [ -4.3663794 -1.8572003 -2.7994649 ] [ -0.8704203 2.5839956 2.1280952 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.475496500947672e-08 1.210141795820837e-09 -1.660942277953131e-08 ] [ -4.221803362879281e-09 -7.629104345108062e-09 5.61573324365121e-10 ] [ 1.12660893641455e-08 -9.530396782310077e-09 2.907841162045898e-09 ] [ 7.417541727118264e-09 1.570046311411736e-08 1.896639716256879e-08 ] [ 8.683415557588117e-09 -9.155580696634175e-10 -4.750736023332911e-09 ] [ -6.995711049858938e-09 -2.97556292531779e-09 -4.485237250483145e-09 ] [ -1.39456706641927e-09 4.14001737267881e-09 3.409584404367557e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.7306947 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.078376177892764e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4547374 1.5681392 1.3662914 ] [ 2.2576881 0.3782495 3.112352 ] [ 3.7896583 1.4133232 4.0116179 ] [ 4.0810644 3.3971108 2.8680255 ] [ 6.3264528 3.5289328 1.925341 ] [ 2.4936953 3.3338301 1.1933928 ] [ 3.7080357 5.305472 4.3400304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4547374e-10 1.5681392e-10 1.3662914e-10 ] [ 2.2576881e-10 3.782495000000001e-11 3.112352e-10 ] [ 3.7896583e-10 1.4133232e-10 4.0116179e-10 ] [ 4.0810644e-10 3.3971108e-10 2.8680255e-10 ] [ 6.3264528e-10 3.5289328e-10 1.925341e-10 ] [ 2.4936953e-10 3.3338301e-10 1.1933928e-10 ] [ 3.7080357e-10 5.305472e-10 4.3400304e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.2e-05 6.9e-06 -1.4e-06 ] [ -3e-07 -4.7e-06 -8.5e-06 ] [ 3e-07 -1.07e-05 3.9e-06 ] [ 2.29e-05 3.19e-05 7.9e-06 ] [ -8.3e-05 -1.74e-05 7.8e-06 ] [ 7.5e-06 -1.08e-05 -7.6e-06 ] [ 2.07e-05 4.8e-06 -2.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.126965228799999e-14 1.10550187746e-14 -2.2430472876e-15 ] [ -4.806529901999999e-16 -7.530230179799999e-15 -1.3618501389e-14 ] [ 4.806529901999999e-16 -1.71432899838e-14 6.248488872599999e-15 ] [ 3.66898449186e-14 5.11094346246e-14 1.26571954086e-14 ] [ -1.32980660622e-13 -2.78778734316e-14 1.24969777452e-14 ] [ 1.2016324755e-14 -1.73035076472e-14 -1.21765424184e-14 ] [ 3.316505632379999e-14 7.690447843199998e-15 -3.5247885948e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.039816 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.890297167685934e-18 } }