{ "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" [ [ 1.570546 2.153895 2.543093 ] [ 2.524346 2.661693 4.212043 ] [ 2.241813 4.238266 2.673997 ] [ 3.729345 1.325386 1.859362 ] [ 4.629957 2.667135 3.458757 ] [ 3.970969 3.734581 1.387215 ] [ 4.050613 4.976756 3.428708 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.570546e-10 2.153895e-10 2.543093e-10 ] [ 2.524346e-10 2.661693e-10 4.212043000000001e-10 ] [ 2.241813e-10 4.238266e-10 2.673997e-10 ] [ 3.729345e-10 1.325386e-10 1.859362e-10 ] [ 4.629957e-10 2.667135e-10 3.458757e-10 ] [ 3.970969e-10 3.734581e-10 1.387215e-10 ] [ 4.050613e-10 4.976756e-10 3.428708e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -18.9028453 -10.9767423 -6.3426228 ] [ -6.3666034 -5.2506584 21.4127965 ] [ -15.5548744 15.2834639 -3.5414659 ] [ 4.7819613 -17.5993805 -9.8691801 ] [ 18.4410973 -6.0746555 9.4430136 ] [ 8.2847341 6.0829353 -19.2551795 ] [ 9.3165304 18.5350376 8.1526382 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.028569680625916e-08 -1.758667988560642e-08 -1.016200196471304e-08 ] [ -1.020042312138579e-08 -8.412482132287135e-09 3.430708193824807e-08 ] [ -2.492165610316043e-08 2.448680854542079e-08 -5.67405386834043e-09 ] [ 7.661546596430375e-09 -2.819731597766341e-08 -1.581216962268461e-08 ] [ 2.9545894955958e-08 -9.732671021514135e-09 1.512937561981644e-08 ] [ 1.327360728456453e-08 9.745936723499035e-09 -3.085019842420743e-08 ] [ 1.492672719385247e-08 2.969640390836894e-08 1.3061966321881e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 163.1402 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.613794143526362e-17 } "relaxed-configuration-positions" { "source-value" [ [ -3.9608522 -1.0517191 0.863325 ] [ 0.7649005 1.723773 9.3361301 ] [ -2.2830157 8.7693324 1.7187829 ] [ 5.3216743 -4.2619904 -1.0152004 ] [ 10.2352285 0.855398 6.0324458 ] [ 5.9581316 5.521039 -3.2845228 ] [ 6.681522 10.2018791 5.9122144 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.9608522e-10 -1.0517191e-10 8.633250000000001e-11 ] [ 7.649005e-11 1.723773e-10 9.3361301e-10 ] [ -2.2830157e-10 8.7693324e-10 1.7187829e-10 ] [ 5.3216743e-10 -4.261990400000001e-10 -1.0152004e-10 ] [ 1.02352285e-09 8.55398e-11 6.0324458e-10 ] [ 5.958131599999999e-10 5.521039e-10 -3.2845228e-10 ] [ 6.681522e-10 1.02018791e-09 5.912214400000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] [ -0.0 0.0 -0.0 ] [ 0.0 -0.0 -0.0 ] [ 0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 4.4408921e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.115093498115416e-34 } }