{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0450915 0.6744384 2.108849 ] [ 0.1091138 2.224666 0.3426204 ] [ 1.10319 2.788623 2.698849 ] [ 2.780637 1.123883 1.270131 ] [ 2.821139 0.9081744 2.973557 ] [ 2.438974 2.484533 0.05951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.50915e-12 6.744384e-11 2.108849e-10 ] [ 1.091138e-11 2.224666e-10 3.426204e-11 ] [ 1.10319e-10 2.788623e-10 2.698849e-10 ] [ 2.780637e-10 1.123883e-10 1.270131e-10 ] [ 2.821139e-10 9.081744000000001e-11 2.973557e-10 ] [ 2.438974e-10 2.484533e-10 5.951e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6011671 -1.5690611 0.2610784 ] [ -1.6959214 0.9706544 -2.1518644 ] [ -1.419327 3.1253178 3.6945517 ] [ 5.383775 -7.5521098 -9.261303 ] [ 0.6982178 -0.6759727 12.4438765 ] [ -1.3655773 5.7011714 -4.9863393 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.565352493614136e-09 -2.513913011026731e-09 4.182937086758707e-10 ] [ -2.717165617794405e-09 1.555159786556652e-09 -3.447666832811819e-09 ] [ -2.274012536670202e-09 5.007311111730091e-09 5.919324358076895e-09 ] [ 8.62575843664752e-09 -1.209981375927457e-08 -1.48382431447449e-08 ] [ 1.11866823538641e-09 -1.083027656239052e-09 1.993728800042253e-08 ] [ -2.187896023955188e-09 9.134283528253606e-09 -7.988996249836237e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.8872346 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.830213016484841e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.1868733 0.7608695 1.8139102 ] [ 0.0192544 2.1157382 -0.076702 ] [ 1.2946906 2.7402292 2.8608014 ] [ 2.5645029 0.4551662 1.1106768 ] [ 3.0801276 1.2857012 3.2278756 ] [ 2.1526965 2.8466135 0.5169543 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.868733e-11 7.608695e-11 1.8139102e-10 ] [ 1.92544e-12 2.1157382e-10 -7.6702e-12 ] [ 1.2946906e-10 2.7402292e-10 2.8608014e-10 ] [ 2.5645029e-10 4.551662e-11 1.1106768e-10 ] [ 3.0801276e-10 1.2857012e-10 3.2278756e-10 ] [ 2.1526965e-10 2.8466135e-10 5.169543e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.6e-06 -1.8e-06 5.6e-06 ] [ 1.06e-05 -2.2e-06 9.1e-06 ] [ -9.2e-06 1.14e-05 1.5e-06 ] [ -1.5e-06 -1.8e-06 -4.5e-06 ] [ -1.35e-05 2e-07 -2.11e-05 ] [ 4.1e-06 -5.8e-06 9.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.538089555968e-14 -2.88391791744e-15 8.972189076479999e-15 ] [ 1.698307218048e-14 -3.52478856576e-15 1.457980724928e-14 ] [ -1.474002491136e-14 1.826481347712e-14 2.4032649312e-15 ] [ -2.4032649312e-15 -2.88391791744e-15 -7.2097947936e-15 ] [ -2.16293843808e-14 3.2043532416e-16 -3.380592669888e-14 ] [ 6.568924145279999e-15 -9.292624400640001e-15 1.506046023552e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.917847 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.749231921287142e-18 } }