{ "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" [ [ 0.5308739 0.2525778 2.81745 ] [ 0.4737551 1.568741 0.832487 ] [ 2.312512 2.941662 0.559243 ] [ 2.76942 1.516894 1.016982 ] [ 2.535548 1.814472 2.698768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.308739e-11 2.525778e-11 2.81745e-10 ] [ 4.737551e-11 1.568741e-10 8.32487e-11 ] [ 2.312512e-10 2.941662e-10 5.592430000000001e-11 ] [ 2.76942e-10 1.516894e-10 1.016982e-10 ] [ 2.535548e-10 1.814472e-10 2.698768e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.0605652 -15.777995 14.2056827 ] [ -26.1436346 -1.2818654 -13.1784452 ] [ 20.9640698 -21.3832009 -0.9037428 ] [ 4.0646613 36.9461157 -13.7856312 ] [ 13.1754687 1.4969456 13.6621365 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.932315559707408e-08 -2.52791347120993e-08 2.276001270444302e-08 ] [ -4.188672013885796e-08 -2.05377477489244e-09 -2.111419679793398e-08 ] [ 3.358814251037933e-08 -3.425966455984952e-08 -1.44795558537633e-09 ] [ 6.512305306330536e-09 5.919420280391183e-08 -2.208701601161105e-08 ] [ 2.110942791922217e-08 2.398371242929429e-09 2.188915569047834e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 215.58758 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.454093804108497e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.3222657 -0.0207542 3.0634552 ] [ 0.0203699 1.5462939 0.6044159 ] [ 2.7585411 2.3638482 0.6558445 ] [ 2.7585411 2.3638482 0.6558445 ] [ 2.7623912 1.8411108 2.9453699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.222657e-11 -2.07542e-12 3.0634552e-10 ] [ 2.03699e-12 1.5462939e-10 6.044159e-11 ] [ 2.7585411e-10 2.3638482e-10 6.558445e-11 ] [ 2.7585411e-10 2.3638482e-10 6.558445e-11 ] [ 2.7623912e-10 1.8411108e-10 2.9453699e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.1414138 -9.9802351 8.7629823 ] [ -16.2234519 -0.78394 -7.9257485 ] [ 8.0126037 6.0173099 1.8087366456817632e+115 ] [ 8.0126037 6.0173099 -1.8087366456817632e+115 ] [ 7.3396584 -1.2704447 23.8751227 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.144180622981849e-08 -1.599009934730755e-08 1.403984536954421e-08 ] [ -2.599283534285334e-08 -1.256010340109952e-09 -1.269844894904067e-08 ] [ 1.283760631987558e-08 9.640793241888385e-09 2.897915566895534e+106 ] [ 1.283760631987558e-08 9.640793241888385e-09 -2.897915566895534e+106 ] [ 1.175942909313834e-08 -2.03547679635927e-09 3.825216340867137e-08 ] ] } "relaxed-potential-energy" { "source-value" -3.3468351e+98 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.362220950892831e+79 } }