{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.594162e-11 5.888728e-11 1.0370732e-10 ] [ 1.0155362e-10 2.8122659e-10 3.966957e-11 ] [ 2.948545e-11 2.3897732e-10 2.7179279e-10 ] [ 2.554107e-10 8.877016e-11 5.239842e-11 ] [ 1.8332549e-10 4.652643e-11 2.8452031e-10 ] [ 2.6894573e-10 2.6886464e-10 2.2046879e-10 ] ] "source-value" [ [ 0.1594162 0.5888728 1.0370732 ] [ 1.0155362 2.8122659 0.3966957 ] [ 0.2948545 2.3897732 2.7179279 ] [ 2.554107 0.8877016 0.5239842 ] [ 1.8332549 0.4652643 2.8452031 ] [ 2.6894573 2.6886464 2.2046879 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.2849456498816e-12 9.4880899483776e-13 1.7976421685376e-13 ] [ 6.3638455378176e-13 -1.19490332379264e-12 -4.229746278912e-13 ] [ 8.6020862770752e-13 -8.6245167497664e-13 -2.315145217056e-13 ] [ -1.83465244847808e-12 1.17327393941184e-12 2.5330412374848e-13 ] [ -1.9354293579264e-13 7.575091063142399e-13 2.707678489152e-14 ] [ -7.5334344710016e-13 -8.222370417945601e-13 1.9434402410304e-13 ] ] "source-value" [ [ 0.000802 0.0005922 0.0001122 ] [ 0.0003972 -0.0007458 -0.000264 ] [ 0.0005369 -0.0005383 -0.0001445 ] [ -0.0011451 0.0007323 0.0001581 ] [ -0.0001208 0.0004728 1.69e-05 ] [ -0.0004702 -0.0005132 0.0001213 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.295436822274818e-18 "source-value" -20.568499 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.758784719002279e-09 -8.892942857332638e-09 -1.494578444388624e-09 ] [ -8.703279752444927e-11 9.794623506434243e-09 2.949082926702475e-09 ] [ -3.196735372421083e-09 -7.874835878421389e-10 -1.438808118177535e-09 ] [ 4.665339810086284e-09 -1.252587610194937e-09 -6.401235373399548e-09 ] [ -2.444935942930388e-09 -1.035965640614997e-09 8.246108587194698e-09 ] [ 3.822148861574252e-09 2.174356029332807e-09 -1.860569577931465e-09 ] ] "source-value" [ [ -1.721898 -5.5505384 -0.9328425 ] [ -0.0543216 6.1133232 1.8406728 ] [ -1.9952453 -0.4915086 -0.8980334 ] [ 2.9118761 -0.7818037 -3.9953369 ] [ -1.526009 -0.6465989 5.1468162 ] [ 2.3855977 1.3571263 -1.1612762 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.561043760027818e-18 "source-value" -15.984778 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 4.191919e-11 8.222526e-11 2.510936e-11 ] [ 2.848942e-11 2.623705000000001e-10 3.718827e-11 ] [ 6.213019e-11 2.72569e-10 2.983351e-10 ] [ 2.411362e-10 3.472546e-11 8.650246000000001e-11 ] [ 2.114314e-10 6.145619e-11 2.800723e-10 ] [ 2.695562e-10 2.69906e-10 2.453497e-10 ] ] "source-value" [ [ 0.4191919 0.8222526 0.2510936 ] [ 0.2848942 2.623705 0.3718827 ] [ 0.6213019 2.72569 2.983351 ] [ 2.411362 0.3472546 0.8650246 ] [ 2.114314 0.6145619 2.800723 ] [ 2.695562 2.69906 2.453497 ] ] } "instance-id" 1 }