{ "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" [ [ 2.376748 2.356906 1.723048 ] [ 1.891208 1.427855 3.861744 ] [ 2.621896 4.609245 2.418974 ] [ 4.560356 2.199202 1.122098 ] [ 4.097908 2.987714 3.135416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.376748e-10 2.356906e-10 1.723048e-10 ] [ 1.891208e-10 1.427855e-10 3.861744e-10 ] [ 2.621896e-10 4.609245e-10 2.418974e-10 ] [ 4.560356e-10 2.199202e-10 1.122098e-10 ] [ 4.097908e-10 2.987714e-10 3.135416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3866012 -0.1576284 0.377749 ] [ 1.3302982 1.0002357 -1.1038863 ] [ -0.0967816 -0.1471888 -0.0647002 ] [ 0.7841984 -0.5557792 -1.0080182 ] [ -0.6311138 -0.1396392 1.7988557 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.221580025013225e-09 -2.525485372541107e-10 6.052206163305792e-10 ] [ 2.131372674732323e-09 1.602554253829523e-09 -1.768620821881415e-09 ] [ -1.550612168436173e-10 -2.35822454203607e-10 -1.036611478010842e-10 ] [ 1.256424342548767e-09 -8.904564405669275e-10 -1.615023193380899e-09 ] [ -1.011155775424247e-09 -2.237266615872154e-10 2.882084546732819e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.090835 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.097382978375037e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0351196 2.0337552 1.3147264 ] [ 2.0917049 2.0953929 3.6740325 ] [ 2.7373441 4.0955009 2.4251226 ] [ 4.3136907 2.6472902 1.2440509 ] [ 4.3702567 2.7089829 3.6033476 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0351196e-10 2.0337552e-10 1.3147264e-10 ] [ 2.0917049e-10 2.0953929e-10 3.6740325e-10 ] [ 2.7373441e-10 4.0955009e-10 2.4251226e-10 ] [ 4.313690700000001e-10 2.6472902e-10 1.2440509e-10 ] [ 4.3702567e-10 2.7089829e-10 3.6033476e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.59e-05 -3.24e-05 -6.8e-06 ] [ -1.09e-05 2.3e-06 -1.45e-05 ] [ 2.11e-05 1.37e-05 1.03e-05 ] [ -9e-06 1.29e-05 2.6e-06 ] [ 1.47e-05 3.4e-06 8.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.547460827072e-14 -5.191052251392001e-14 -1.089480102144e-14 ] [ -1.746372516672e-14 3.68500622784e-15 -2.32315610016e-14 ] [ 3.380592669888e-14 2.194981970496e-14 1.650241919424e-14 ] [ -1.44195895872e-14 2.066807840832e-14 4.16565921408e-15 ] [ 2.355199632576e-14 5.44740051072e-15 1.329806595264e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971608059987e-18 } }