{ "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" [ [ -2.0454428 -0.611447 -2.5198341 ] [ -0.6785028 -1.3931098 2.6038292 ] [ 1.8533969 -1.5945988 -1.1065728 ] [ 0.1723486 1.8733455 3.1467726 ] [ -0.2058738 0.1010685 0.6808631 ] [ 0.6195571 2.8228417 -2.1984705 ] [ 0.2845169 -1.1981001 -0.6065876 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.27716063334369e-09 -9.796460882582976e-10 -4.037219283314609e-09 ] [ -1.087081323307338e-09 -2.232007951767363e-09 4.171794268796367e-09 ] [ 2.969469182243195e-09 -2.554828916915735e-09 -1.772925069373194e-09 ] [ 2.761328975476109e-10 3.001430362780887e-09 5.04168549069403e-09 ] [ -3.29846189195255e-10 1.619295877993248e-10 1.090862940785413e-09 ] [ 9.926399008706477e-10 4.522690975959327e-09 -3.522338036618486e-09 ] [ 4.558463254024916e-10 -1.919567969598142e-09 -9.71860471187182e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -21.423881 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.432484126500133e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2900818 1.696935 1.3464249 ] [ 2.0802298 2.0824473 3.6846707 ] [ 4.2027866 1.0727056 2.6160507 ] [ 4.309164 2.6181727 4.4863577 ] [ 5.0971964 3.2962597 2.2915785 ] [ 3.1571962 3.8525583 1.0318123 ] [ 2.9746771 4.305979 3.3601561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2900818e-10 1.696935e-10 1.3464249e-10 ] [ 2.0802298e-10 2.0824473e-10 3.6846707e-10 ] [ 4.2027866e-10 1.0727056e-10 2.616050700000001e-10 ] [ 4.309164e-10 2.6181727e-10 4.4863577e-10 ] [ 5.0971964e-10 3.2962597e-10 2.2915785e-10 ] [ 3.1571962e-10 3.8525583e-10 1.0318123e-10 ] [ 2.9746771e-10 4.305979e-10 3.3601561e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6e-06 6.9e-06 -3.5e-06 ] [ 4.61e-05 -1.26e-05 7.3e-06 ] [ -1.25e-05 -1.05e-05 2.82e-05 ] [ -4.55e-05 -3.2e-06 -3.3e-05 ] [ 6.3e-06 2.1e-06 -9.7e-06 ] [ -5.4e-06 7.9e-06 4.4e-06 ] [ 5e-06 9.3e-06 6.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.6130597248e-15 1.105501868352e-14 -5.6076181728e-15 ] [ 7.386034221888001e-14 -2.018742542208e-14 1.169588933184e-14 ] [ -2.002720776e-14 -1.68228545184e-14 4.518138070656001e-14 ] [ -7.28990362464e-14 -5.126965186560001e-15 -5.28718284864e-14 ] [ 1.009371271104e-14 3.36457090368e-15 -1.554111322176e-14 ] [ -8.65175375232e-15 1.265719530432e-14 7.04957713152e-15 ] [ 8.010883104e-15 1.490024257344e-14 1.025393037312e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.628085 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.945854200207517e-18 } }