{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.864683 1.866161 1.825326 ] [ 1.617619 4.144917 1.356057 ] [ 3.090269 3.905988 2.739114 ] [ 3.727671 1.752123 3.16656 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.864683e-10 1.866161e-10 1.825326e-10 ] [ 1.617619e-10 4.144917000000001e-10 1.356057e-10 ] [ 3.090269e-10 3.905988e-10 2.739114e-10 ] [ 3.727671e-10 1.752123e-10 3.16656e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2462795 0.3003221 -0.1043183 ] [ -4.3540678 1.0190423 -4.1527764 ] [ 3.6012261 -0.0310806 3.5815331 ] [ 0.9991213 -1.2882838 0.6755617 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.945832570823136e-10 4.811690473295597e-10 -1.671363413816006e-10 ] [ -6.97598563453809e-09 1.63268574866626e-09 -6.653481259489988e-09 ] [ 5.769800263634763e-09 -4.979661068043648e-11 5.738248599441348e-09 ] [ 1.600768788203303e-09 -2.064058185315383e-09 1.082369161647903e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.6982892 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.553837221799714e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.754108 1.9935035 2.0596532 ] [ 1.6429433 4.1453529 1.0383996 ] [ 2.9807753 3.8605032 2.9915608 ] [ 3.9224154 1.6698294 2.9974434 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.754108e-10 1.9935035e-10 2.0596532e-10 ] [ 1.6429433e-10 4.1453529e-10 1.0383996e-10 ] [ 2.9807753e-10 3.8605032e-10 2.9915608e-10 ] [ 3.9224154e-10 1.6698294e-10 2.9974434e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-07 1e-07 1e-07 ] [ 4e-07 -3e-07 3e-07 ] [ -3e-07 1e-07 -2e-07 ] [ 0.0 0.0 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-16 1.6021766208e-16 1.6021766208e-16 ] [ 6.408706483200001e-16 -4.8065298624e-16 4.8065298624e-16 ] [ -4.8065298624e-16 1.6021766208e-16 -3.2043532416e-16 ] [ 0.0 0.0 -3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -10.766829 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.725036170395144e-18 } }