{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.0834279e-10 2.3914211e-10 1.7573124e-10 ] [ 2.4600561e-10 2.764586e-10 4.9824644e-10 ] [ 1.3462968e-10 3.8887397e-10 3.3369145e-10 ] [ 3.2302888e-10 1.210951e-10 3.3398839e-10 ] [ 4.0105878e-10 3.5792494e-10 1.4604687e-10 ] [ 3.2450358e-10 5.134853299999999e-10 3.1042061e-10 ] [ 4.6251389e-10 3.2066057e-10 3.843167000000001e-10 ] ] "source-value" [ [ 2.0834279 2.3914211 1.7573124 ] [ 2.4600561 2.764586 4.9824644 ] [ 1.3462968 3.8887397 3.3369145 ] [ 3.2302888 1.210951 3.3398839 ] [ 4.0105878 3.5792494 1.4604687 ] [ 3.2450358 5.1348533 3.1042061 ] [ 4.6251389 3.2066057 3.843167 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.31763005294592e-12 -1.94488219998912e-12 -3.01145117645568e-12 ] [ -4.15876985461056e-12 -1.45910224856256e-12 1.155553865985792e-11 ] [ 1.3450272731616e-12 -1.4307437223744e-12 1.9530533007552e-13 ] [ -2.9335853926848e-12 -8.09275432932288e-12 -9.6755446130112e-13 ] [ 1.85644205052096e-12 3.50412048735168e-12 3.3389360777472e-13 ] [ -6.641022093215999e-13 1.085506704124416e-11 -4.519580029614719e-12 ] [ 3.23735807998848e-12 -1.43170502834688e-12 -3.58631214799872e-12 ] ] "source-value" [ [ 0.0008224 -0.0012139 -0.0018796 ] [ -0.0025957 -0.0009107 0.0072124 ] [ 0.0008395 -0.000893 0.0001219 ] [ -0.001831 -0.0050511 -0.0006039 ] [ 0.0011587 0.0021871 0.0002084 ] [ -0.0004145 0.0067752 -0.0028209 ] [ 0.0020206 -0.0008936 -0.0022384 ] ] } "species" { "source-value" [ "Si" "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" -2.314441060431159e-18 "source-value" -14.445605 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -4.172730580813563e-09 -1.511929216103578e-09 -2.492333133903514e-09 ] [ -4.868377885404432e-09 -1.369716494452804e-09 1.29348851971077e-08 ] [ -6.252020018392243e-09 3.057017399986556e-09 -2.639107572829029e-09 ] [ -9.87984296045927e-10 -1.576331092619799e-08 -2.114224738577563e-09 ] [ 4.53612330431279e-09 1.202241452933566e-09 -1.03448691170283e-08 ] [ -2.00384534377014e-09 1.264588297607118e-08 -1.03698574646946e-09 ] [ 1.374883465989585e-08 1.739814647545403e-09 5.692635111700159e-09 ] ] "source-value" [ [ -2.6044136 -0.943672 -1.555592 ] [ -3.0386025 -0.8549098 8.0733204 ] [ -3.902204 1.9080402 -1.6472014 ] [ -0.6166513 -9.8386849 -1.3195953 ] [ 2.8312255 0.7503801 -6.4567595 ] [ -1.2507019 7.8929394 -0.6472356 ] [ 8.5813477 1.0859069 3.5530634 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.524554464006079e-18 "source-value" -9.5155206 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.992263e-10 2.655886e-10 1.517325e-10 ] [ 2.686183e-10 2.997874e-10 4.828117e-10 ] [ 1.135569e-10 3.58045e-10 3.551064e-10 ] [ 3.228076e-10 1.641916e-10 3.257925e-10 ] [ 4.134079e-10 3.318369e-10 1.708542e-10 ] [ 3.231459e-10 4.785804e-10 3.060879e-10 ] [ 4.593203e-10 3.196107e-10 3.900565e-10 ] ] "source-value" [ [ 1.992263 2.655886 1.517325 ] [ 2.686183 2.997874 4.828117 ] [ 1.135569 3.58045 3.551064 ] [ 3.228076 1.641916 3.257925 ] [ 4.134079 3.318369 1.708542 ] [ 3.231459 4.785804 3.060879 ] [ 4.593203 3.196107 3.900565 ] ] } "instance-id" 1 }