{ "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" [ [ 2.263215 2.218791 2.823685 ] [ 2.787552 3.729015 0.8142493 ] [ 2.212325 4.309555 3.289264 ] [ 3.882235 1.940561 0.9401229 ] [ 4.958804 1.525412 3.341241 ] [ 4.281489 4.073298 2.625609 ] [ 3.697667 3.229021 4.691712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.263215e-10 2.218791e-10 2.823685e-10 ] [ 2.787552e-10 3.729015e-10 8.142493e-11 ] [ 2.212325e-10 4.309555e-10 3.289264e-10 ] [ 3.882235e-10 1.940561e-10 9.401229e-11 ] [ 4.958804e-10 1.525412e-10 3.341241e-10 ] [ 4.281489e-10 4.073298000000001e-10 2.625609e-10 ] [ 3.697667e-10 3.229021e-10 4.691712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.8285586 -9.4282047 -1.0243498 ] [ 0.8289954 2.2211063 -6.81956 ] [ -7.3532158 5.3772668 4.6136506 ] [ 0.8265538 -3.1025212 -0.6014986 ] [ 1.9938209 -2.0389813 0.0133218 ] [ 9.6122698 7.9990294 -4.7826835 ] [ 2.9201345 -1.0276953 8.6011195 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.414491018428278e-08 -1.510564914645668e-08 -1.641189301081156e-09 ] [ 1.328197048630744e-09 3.558604586171591e-09 -1.092613959614285e-08 ] [ -1.178115044245717e-08 8.61533115076403e-09 7.391883127859892e-09 ] [ 1.324285174193399e-09 -4.970786932176362e-09 -9.63706994363931e-10 ] [ 3.194453232042415e-09 -3.266808169108391e-09 2.134387650697344e-11 ] [ 1.540055394638189e-08 1.281585789377185e-08 -7.662703688385916e-09 ] [ 4.678571225491498e-09 -1.646549382966042e-09 1.378051257560699e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -8.2682852 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.324725324154665e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9732707 2.1109647 3.390864 ] [ 3.3594082 4.0727347 1.1054133 ] [ 1.1795087 4.2959782 2.396978 ] [ 3.3607252 1.6422438 1.3948567 ] [ 5.4710231 1.5258226 2.7928272 ] [ 4.7597366 4.5148684 2.9562597 ] [ 3.9796144 2.8630407 4.4886843 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9732707e-10 2.1109647e-10 3.390864e-10 ] [ 3.3594082e-10 4.0727347e-10 1.1054133e-10 ] [ 1.1795087e-10 4.295978200000001e-10 2.396978e-10 ] [ 3.3607252e-10 1.6422438e-10 1.3948567e-10 ] [ 5.471023100000001e-10 1.5258226e-10 2.7928272e-10 ] [ 4.7597366e-10 4.5148684e-10 2.9562597e-10 ] [ 3.9796144e-10 2.8630407e-10 4.4886843e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.9e-06 -6e-07 -7.1e-06 ] [ -4.2e-06 4.5e-06 2e-07 ] [ 4.7e-06 -6.1e-06 -8.7e-06 ] [ -1.81e-05 -3.1e-06 -3.2e-06 ] [ -4.1e-06 6.5e-06 9.7e-06 ] [ 3.3e-06 4.9e-06 3.1e-06 ] [ 1.36e-05 -6.2e-06 6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.850665441919999e-15 -9.6130597248e-16 -1.137545400768e-14 ] [ -6.72914180736e-15 7.2097947936e-15 3.2043532416e-16 ] [ 7.53023011776e-15 -9.77327738688e-15 -1.393893660096e-14 ] [ -2.899939683648e-14 -4.96674752448e-15 -5.126965186560001e-15 ] [ -6.568924145279999e-15 1.04141480352e-14 1.554111322176e-14 ] [ 5.28718284864e-15 7.850665441919999e-15 4.96674752448e-15 ] [ 2.178960204288e-14 -9.93349504896e-15 9.6130597248e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.891963 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.026826143961863e-18 } }