{ "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" [ [ 2.271696 2.59158 0.2830491 ] [ 1.885666 2.994299 3.04756 ] [ 2.618377 0.6246748 1.626494 ] [ 2.195128 4.700519 1.092758 ] [ 3.86025 2.803257 1.694059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.271696e-10 2.59158e-10 2.830491e-11 ] [ 1.885666e-10 2.994299e-10 3.04756e-10 ] [ 2.618377e-10 6.246748e-11 1.626494e-10 ] [ 2.195128e-10 4.700519e-10 1.092758e-10 ] [ 3.86025e-10 2.803257e-10 1.694059e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.015162 -1.2884821 -2.102023 ] [ 0.5800237 0.0173921 -1.3444011 ] [ -0.1010992 1.2759657 0.2785407 ] [ -0.0229966 -0.1718196 1.2003703 ] [ 1.5592341 0.166944 1.9675131 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.22864544352457e-09 -2.064375896939288e-09 -3.367812106983878e-09 ] [ 9.29300411649913e-10 2.786521600661568e-11 -2.153968011397803e-09 ] [ -1.619787746215833e-10 2.044322413482707e-09 4.462713974812666e-10 ] [ -3.684461487788928e-11 -2.752853461152077e-10 1.923205230962682e-09 ] [ 2.49816842137413e-09 2.674737737828352e-10 3.152303489937732e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.621984775408901 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.405235948853681e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.4032338 2.4975382 -0.1257241 ] [ 2.0415637 2.9244167 3.1557999 ] [ 2.3524441 1.0673847 1.7431781 ] [ 2.0923531 4.3545703 1.2868978 ] [ 3.9415223 2.8704199 1.6837684 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4032338e-10 2.4975382e-10 -1.257241e-11 ] [ 2.0415637e-10 2.9244167e-10 3.1557999e-10 ] [ 2.3524441e-10 1.0673847e-10 1.7431781e-10 ] [ 2.0923531e-10 4.3545703e-10 1.2868978e-10 ] [ 3.9415223e-10 2.8704199e-10 1.6837684e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-07 1.7e-06 4e-07 ] [ 0.0 -5e-07 4e-07 ] [ -2e-07 -7e-07 7e-07 ] [ 5e-07 -9e-07 -1.4e-06 ] [ -3e-07 4e-07 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-16 2.72370025536e-15 6.408706483200001e-16 ] [ 0.0 -8.010883104e-16 6.408706483200001e-16 ] [ -3.2043532416e-16 -1.12152363456e-15 1.12152363456e-15 ] [ 8.010883104e-16 -1.44195895872e-15 -2.24304726912e-15 ] [ -4.8065298624e-16 6.408706483200001e-16 -3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -5.786807775408899 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.271488126823796e-19 } }