{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7872548 2.971705 2.821442 ] [ 1.838331 0.4014098 1.675971 ] [ 2.974058 1.714847 0.8061894 ] [ 1.598524 2.494897 0.1079685 ] [ 2.930835 1.52262 2.533969 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.872548000000001e-11 2.971705e-10 2.821442e-10 ] [ 1.838331e-10 4.014098e-11 1.675971e-10 ] [ 2.974058e-10 1.714847e-10 8.061894e-11 ] [ 1.598524e-10 2.494897e-10 1.079685e-11 ] [ 2.930835e-10 1.52262e-10 2.533969e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.4002907 -3.9518534 -0.2966649 ] [ -21.112138 -30.4770712 -0.2980794 ] [ 28.1892338 1.1769983 -21.8835771 ] [ -20.2617359 17.3787415 -15.3031666 ] [ 6.7843493 15.8731848 37.7814879 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.02543962103475e-08 -6.331567178473455e-09 -4.753095709079466e-10 ] [ -3.382537419738349e-08 -4.882965134939433e-08 -4.775758497567396e-10 ] [ 4.516413172472302e-08 1.885759174517722e-09 -3.506135589795748e-08 ] [ -3.246287982325896e-08 2.784381355962611e-08 -2.451837595272922e-08 ] [ 1.086972592535425e-08 2.543164579372396e-08 6.053261711113372e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 11.972005 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.918126667313117e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9459607 3.1230094 4.0052224 ] [ 2.084229 -0.3275375 1.7288758 ] [ 2.8730741 1.6761401 0.4587371 ] [ 1.722855 2.8072792 -1.1739201 ] [ 2.5028841 1.8265875 2.9266248 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.459607000000001e-11 3.1230094e-10 4.0052224e-10 ] [ 2.084229e-10 -3.275375e-11 1.7288758e-10 ] [ 2.8730741e-10 1.6761401e-10 4.587371e-11 ] [ 1.722855e-10 2.8072792e-10 -1.1739201e-10 ] [ 2.5028841e-10 1.8265875e-10 2.9266248e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.41e-05 0.0001042 -0.0002821 ] [ 0.0001601 -0.0002734 -0.0007497 ] [ -1.8e-06 -0.0007183 -0.0005889 ] [ -0.0001346 0.000169 0.0001851 ] [ -4.78e-05 0.0007184 0.0014355 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.86124568794e-14 1.669468052628e-13 -4.519740284514e-13 ] [ 2.565084791033999e-13 -4.380350917355999e-13 -1.2011518225098e-12 ] [ -2.8839179412e-15 -1.1508434762022e-12 -9.435218197625998e-13 ] [ -2.156529749364e-13 2.707678511459999e-13 2.965628949534e-13 ] [ -7.65840431052e-14 1.1510036938656e-12 2.299924558107e-12 ] ] } "relaxed-potential-energy" { "source-value" -10.138955 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.624439679417747e-18 } }