{ "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" [ [ 0.8403174 0.0019487 1.613535 ] [ 0.0637823 2.769237 1.974876 ] [ 2.710551 0.627508 0.2521163 ] [ 2.357874 0.9595638 1.99039 ] [ 1.619464 1.82467 0.5389468 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.403174e-11 1.9487e-13 1.613535e-10 ] [ 6.37823e-12 2.769237e-10 1.974876e-10 ] [ 2.710551e-10 6.27508e-11 2.521163e-11 ] [ 2.357874e-10 9.595638e-11 1.99039e-10 ] [ 1.619464e-10 1.82467e-10 5.389467999999999e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.359453 -7.8635121 3.1519329 ] [ 0.3964048 -0.2552865 -0.4948972 ] [ 14.1128519 -10.2179437 -13.3572139 ] [ 7.4593894 0.7218009 16.8954166 ] [ -11.6091931 17.6149414 -6.1952385 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.659767340087642e-08 -1.259873524399791e-08 5.049953202710344e-09 ] [ 6.351105029328999e-10 -4.090140619058592e-10 -7.929127235393818e-10 ] [ 2.261128136699286e-08 -1.637095050879065e-08 -2.140061582960479e-08 ] [ 1.195125930212334e-08 1.156452526852399e-09 2.706944147519623e-08 ] [ -1.859997777117268e-08 2.822224728784202e-08 -9.925866284980062e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 2.68086 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.295211215637888e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5245549 -0.203019 1.6011134 ] [ 0.4894554 2.2582391 1.9753159 ] [ 2.5351403 0.4635924 0.2925911 ] [ 2.5884169 1.126874 2.6918024 ] [ 1.4544212 2.5372411 -0.1909587 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.245549000000001e-11 -2.03019e-11 1.6011134e-10 ] [ 4.894554e-11 2.2582391e-10 1.9753159e-10 ] [ 2.5351403e-10 4.635924e-11 2.925911e-11 ] [ 2.5884169e-10 1.126874e-10 2.6918024e-10 ] [ 1.4544212e-10 2.5372411e-10 -1.909587e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-05 1.3e-06 -8.6e-06 ] [ -3.32e-05 -2.26e-05 3.19e-05 ] [ -1.95e-05 -7.1e-06 -4e-06 ] [ 3.1e-05 1.8e-05 1.5e-05 ] [ 3.18e-05 1.04e-05 -3.43e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-14 2.08282960704e-15 -1.377871893888e-14 ] [ -5.319226381056e-14 -3.620919163008e-14 5.110943420352001e-14 ] [ -3.12424441056e-14 -1.137545400768e-14 -6.4087064832e-15 ] [ 4.96674752448e-14 2.88391791744e-14 2.4032649312e-14 ] [ 5.094921654144e-14 1.666263685632e-14 -5.495465809344e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.393797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.665269855474118e-18 } }