{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.769072 1.556883 1.447632 ] [ 2.706705 2.541189 3.648112 ] [ 2.031108 4.136433 1.782649 ] [ 3.490046 0.5483522 2.253956 ] [ 3.629143 2.897596 1.184251 ] [ 4.796562 2.667265 3.117649 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.769072e-10 1.556883e-10 1.447632e-10 ] [ 2.706705e-10 2.541189e-10 3.648112e-10 ] [ 2.031108e-10 4.136433e-10 1.782649e-10 ] [ 3.490046e-10 5.483522e-11 2.253956e-10 ] [ 3.629143e-10 2.897596e-10 1.184251e-10 ] [ 4.796562e-10 2.667265e-10 3.117649e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5611841 -4.4088544 -3.7143833 ] [ -3.7347919 -0.1196469 14.3217391 ] [ -0.2617819 5.9542248 1.2034758 ] [ 0.7317605 -10.4705013 2.7656527 ] [ 6.3150841 6.8333375 -13.2177041 ] [ -0.4890866 2.2114402 -1.3587804 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.10346928658469e-09 -7.063763444191212e-09 -5.951098083949953e-09 ] [ -5.983796265733211e-09 -1.916954659311955e-10 2.294595555521723e-08 ] [ -4.194208399286036e-10 9.539719769547557e-09 1.928180790458577e-09 ] [ 1.172409565124918e-09 -1.677559239091601e-08 4.431064097192396e-09 ] [ 1.011788010340581e-08 1.094821358453592e-08 -2.11770964896723e-08 ] [ -7.836031160665613e-10 3.543117786737277e-09 -2.177006189681273e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.8118222 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.311565653086422e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.9597776 1.3084521 1.6007569 ] [ 2.1989354 2.7732438 3.6203832 ] [ 2.1188928 4.890157 2.0577687 ] [ 4.0219705 -0.107591 2.4203068 ] [ 3.5356908 3.0762389 0.780311 ] [ 4.5873689 2.4072174 2.9547224 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9597776e-10 1.3084521e-10 1.6007569e-10 ] [ 2.1989354e-10 2.7732438e-10 3.6203832e-10 ] [ 2.1188928e-10 4.890157e-10 2.0577687e-10 ] [ 4.0219705e-10 -1.07591e-11 2.4203068e-10 ] [ 3.5356908e-10 3.0762389e-10 7.80311e-11 ] [ 4.587368900000001e-10 2.4072174e-10 2.9547224e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.76e-05 9.4e-06 1.49e-05 ] [ 2.8e-06 -2.2e-06 -2.5e-05 ] [ 3.75e-05 -3.75e-05 4e-06 ] [ -5e-07 5.67e-05 9.7e-06 ] [ -3.33e-05 8.8e-06 1.46e-05 ] [ -4.42e-05 -3.52e-05 -1.82e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.024184094208e-14 1.506046023552e-14 2.387243164992e-14 ] [ 4.48609453824e-15 -3.52478856576e-15 -4.005441552e-14 ] [ 6.008162327999999e-14 -6.008162327999999e-14 6.4087064832e-15 ] [ -8.010883104e-16 9.084341439936e-14 1.554111322176e-14 ] [ -5.335248147264001e-14 1.409915426304e-14 2.339177866368e-14 ] [ -7.081620663936001e-14 -5.639661705216e-14 -2.915961449856e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.441499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.474000868790658e-18 } }