{ "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" [ [ 2.176849 1.681974 3.211274 ] [ 2.864727 5.809081 2.248654 ] [ 2.905691 3.612446 1.71083 ] [ 4.50356 2.090932 1.710731 ] [ 5.648677 2.904188 3.876429 ] [ 4.83518 4.522991 2.188517 ] [ 3.438619 4.083879 4.381538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.176849e-10 1.681974e-10 3.211274e-10 ] [ 2.864727e-10 5.809081e-10 2.248654e-10 ] [ 2.905691e-10 3.612446e-10 1.71083e-10 ] [ 4.503560000000001e-10 2.090932e-10 1.710731e-10 ] [ 5.648677e-10 2.904188e-10 3.876429e-10 ] [ 4.835180000000001e-10 4.522991000000001e-10 2.188517e-10 ] [ 3.438619e-10 4.083879e-10 4.381538e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7604653 1.279219 -0.1177228 ] [ -0.7205369 1.4484006 0.8853233 ] [ -3.7519579 -1.8634735 -1.1983179 ] [ 1.0876128 -1.4413682 0.2514298 ] [ -0.4151618 0.1304602 -0.2159904 ] [ 3.3071993 0.8395297 0.4653703 ] [ -0.2676208 -0.3927679 -0.0700924 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.218399724589658e-09 2.049534774683155e-09 -1.886127178951142e-10 ] [ -1.154427375603708e-09 2.320593578872693e-09 1.418444293109505e-09 ] [ -6.011299229605864e-09 -2.985613675180349e-09 -1.919916923666152e-09 ] [ 1.742547800642827e-09 -2.309326432004579e-09 4.028349473324198e-10 ] [ -6.651625298092455e-10 2.090202823848921e-10 -3.460547691972404e-10 ] [ 5.298717398786126e-09 1.345074857807238e-09 7.456054146746823e-10 ] [ -4.287757889997926e-10 -6.292835467807123e-10 -1.123004045757619e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -15.656686 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.508477626840667e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4306729 2.0796383 3.2654426 ] [ 3.1489243 5.2779282 2.5848831 ] [ 2.3427176 3.4828623 1.3082351 ] [ 4.5068474 2.1687235 1.7523972 ] [ 5.3983675 3.1969533 3.9331256 ] [ 5.3103964 4.6002136 1.9759465 ] [ 3.2353769 3.8991717 4.5079429 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4306729e-10 2.0796383e-10 3.2654426e-10 ] [ 3.1489243e-10 5.2779282e-10 2.5848831e-10 ] [ 2.3427176e-10 3.4828623e-10 1.3082351e-10 ] [ 4.5068474e-10 2.1687235e-10 1.7523972e-10 ] [ 5.398367500000001e-10 3.1969533e-10 3.9331256e-10 ] [ 5.3103964e-10 4.6002136e-10 1.9759465e-10 ] [ 3.2353769e-10 3.8991717e-10 4.5079429e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.9e-06 -2.3e-06 -1.75e-05 ] [ 1.52e-05 -4.6e-06 1.39e-05 ] [ -5e-07 2.1e-06 3.79e-05 ] [ 2.1e-06 3e-06 -2.1e-06 ] [ 2.9e-06 2.15e-05 -2e-06 ] [ -1.12e-05 -2.42e-05 7.8e-06 ] [ -1.25e-05 4.5e-06 -3.82e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.24848882112e-15 -3.68500622784e-15 -2.8038090864e-14 ] [ 2.435308463616e-14 -7.370012455680001e-15 2.227025502912e-14 ] [ -8.010883104e-16 3.36457090368e-15 6.072249392832e-14 ] [ 3.36457090368e-15 4.8065298624e-15 -3.36457090368e-15 ] [ 4.646312200320001e-15 3.44467973472e-14 -3.2043532416e-15 ] [ -1.794437815296e-14 -3.877267422336e-14 1.249697764224e-14 ] [ -2.002720776e-14 7.2097947936e-15 -6.120314691456e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.320543 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.93527456749611e-18 } }