{ "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" [ [ 1.63984 2.632724 3.733643 ] [ 2.059322 3.100925 1.548727 ] [ 0.4497259 4.960249 3.35449 ] [ 2.730005 4.489518 3.533282 ] [ 4.056337 2.434117 2.913545 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.63984e-10 2.632724e-10 3.733643e-10 ] [ 2.059322e-10 3.100925e-10 1.548727e-10 ] [ 4.497259e-11 4.960249e-10 3.35449e-10 ] [ 2.730005e-10 4.489518e-10 3.533282e-10 ] [ 4.056337e-10 2.434117e-10 2.913545e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.465751 -6.0721546 5.0644648 ] [ -0.6357796 0.9208225 -5.1802894 ] [ -1.7717802 0.084149 -0.7183472 ] [ 5.0041251 6.0558695 0.8838639 ] [ 1.8691857 -0.9886864 -0.0496921 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.154921846514221e-09 -9.728664138003177e-09 8.114167099424548e-09 ] [ -1.018631211101576e-09 1.475320281406608e-09 -8.299738565658061e-09 ] [ -2.838704813636348e-09 1.348215604636992e-10 -1.150919089457142e-09 ] [ 8.017492242778462e-09 9.702572531515787e-09 1.416106076549109e-09 ] [ 2.994765628473683e-09 -1.584050235382917e-09 -7.961552085845568e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -7.392503 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.184409547579386e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1251709 2.2279323 3.4226656 ] [ 2.2894981 3.0908645 1.3138576 ] [ 0.8927196 4.5957418 4.0315339 ] [ 2.9821928 5.0400418 2.8199342 ] [ 3.6456485 2.6629527 3.4956957 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1251709e-10 2.2279323e-10 3.4226656e-10 ] [ 2.2894981e-10 3.0908645e-10 1.3138576e-10 ] [ 8.927196e-11 4.5957418e-10 4.031533900000001e-10 ] [ 2.9821928e-10 5.0400418e-10 2.8199342e-10 ] [ 3.6456485e-10 2.6629527e-10 3.4956957e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.7e-06 4e-07 2.2e-06 ] [ 2.2e-06 4.4e-06 -2e-07 ] [ 2e-07 -3.5e-06 1.4e-06 ] [ 5e-07 1.1e-06 -5.8e-06 ] [ -4.6e-06 -2.4e-06 2.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.72370025536e-15 6.408706483200001e-16 3.52478856576e-15 ] [ 3.52478856576e-15 7.04957713152e-15 -3.2043532416e-16 ] [ 3.2043532416e-16 -5.6076181728e-15 2.24304726912e-15 ] [ 8.010883104e-16 1.76239428288e-15 -9.292624400640001e-15 ] [ -7.370012455680001e-15 -3.84522388992e-15 4.005441552e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.977047 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.758716806882278e-18 } }