{ "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" [ [ 1.43906 1.00085 1.609326 ] [ 1.205531 2.018769 3.811036 ] [ 1.566383 3.683465 1.956037 ] [ 3.913976 1.646449 1.998722 ] [ 3.334697 0.9502568 4.182978 ] [ 3.589337 3.768444 1.401362 ] [ 3.236168 3.404887 3.941176 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.43906e-10 1.00085e-10 1.609326e-10 ] [ 1.205531e-10 2.018769e-10 3.811036e-10 ] [ 1.566383e-10 3.683465e-10 1.956037e-10 ] [ 3.913976e-10 1.646449e-10 1.998722e-10 ] [ 3.334697e-10 9.502568000000001e-11 4.182978000000001e-10 ] [ 3.589337e-10 3.768444e-10 1.401362e-10 ] [ 3.236168e-10 3.404887e-10 3.941176e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.5401372 2.5079459 2.2612514 ] [ 1.6365292 0.4567293 -1.6486282 ] [ -2.2867522 -3.9958513 2.4753814 ] [ -3.6234314 -0.1422128 1.4524281 ] [ -1.3182547 0.6689367 -1.0274408 ] [ 3.5989855 1.9723421 -0.1465871 ] [ -0.5472136 -1.4678899 -3.3664047 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.069748435464374e-09 4.018172287211215e-09 3.622924126831269e-09 ] [ 2.622008823496527e-09 7.317610064943494e-10 -2.641393558431587e-09 ] [ -3.663780912402966e-09 -6.402059533053287e-09 3.965998206643173e-09 ] [ -5.805377076152613e-09 -2.278500233385062e-10 2.327046345212965e-09 ] [ -2.112076860599718e-09 1.071754741535103e-09 -1.646141629016048e-09 ] [ 5.766210426698198e-09 3.160040400839576e-09 -2.348584245308717e-10 ] [ -8.767328365038028e-10 -2.35181887968845e-09 -5.393574906491237e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.909292 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.151126190388048e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5440707 0.8263018 2.0605135 ] [ 1.1043533 2.2512632 3.9640225 ] [ 1.6746348 3.2252119 1.8308017 ] [ 3.7307693 1.8082011 1.7801746 ] [ 3.0950359 0.8793593 3.9150172 ] [ 3.8596963 4.2027705 1.6038211 ] [ 3.2765916 3.280013 3.7462865 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5440707e-10 8.263018e-11 2.0605135e-10 ] [ 1.1043533e-10 2.2512632e-10 3.9640225e-10 ] [ 1.6746348e-10 3.2252119e-10 1.8308017e-10 ] [ 3.7307693e-10 1.8082011e-10 1.7801746e-10 ] [ 3.0950359e-10 8.793593e-11 3.9150172e-10 ] [ 3.8596963e-10 4.2027705e-10 1.6038211e-10 ] [ 3.2765916e-10 3.280013e-10 3.7462865e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.9e-06 -2.38e-05 -2.06e-05 ] [ -3.24e-05 -4.2e-06 6.92e-05 ] [ -3.2e-06 1.57e-05 -1.52e-05 ] [ 5.23e-05 1.44e-05 -6e-06 ] [ -2.75e-05 -1.71e-05 -1.14e-05 ] [ -6.6e-06 -1.91e-05 2.7e-06 ] [ 2.03e-05 3.41e-05 -1.87e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.646312200320001e-15 -3.813180357504e-14 -3.300483838848e-14 ] [ -5.191052251392001e-14 -6.72914180736e-15 1.1087062215936e-13 ] [ -5.126965186560001e-15 2.515417294656e-14 -2.435308463616e-14 ] [ 8.379383726784e-14 2.307134333952e-14 -9.6130597248e-15 ] [ -4.4059857072e-14 -2.739722021568e-14 -1.826481347712e-14 ] [ -1.057436569728e-14 -3.060157345728e-14 4.32587687616e-15 ] [ 3.252418540224e-14 5.463422276928e-14 -2.996070280896e-14 ] ] } "relaxed-potential-energy" { "source-value" -29.696934 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.757973336424062e-18 } }