{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.93783e-11 2.7259031e-10 2.291742e-10 ] [ 2.2323411e-10 7.89261e-12 1.7211983e-10 ] [ 3.2356045e-10 3.108284e-10 7.806288000000001e-11 ] ] "source-value" [ [ 0.293783 2.7259031 2.291742 ] [ 2.2323411 0.0789261 1.7211983 ] [ 3.2356045 3.108284 0.7806288 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.35159619730688e-12 -9.4961008314816e-13 8.0781745220736e-13 ] [ -3.55394818025856e-12 -8.462056040417279e-12 2.99911441647552e-12 ] [ 4.90554437756544e-12 9.411666123565439e-12 -3.8067716510208e-12 ] ] "source-value" [ [ -0.0008436 -0.0005927 0.0005042 ] [ -0.0022182 -0.0052816 0.0018719 ] [ 0.0030618 0.0058743 -0.002376 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -9.499902315949773e-19 "source-value" -5.9293727 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -8.234152776749665e-08 -2.138818966816919e-08 4.386339048430972e-08 ] [ -1.311447607447286e-07 -3.566017445636641e-07 1.171716287279332e-07 ] [ 2.134862885122253e-07 3.779899342318333e-07 -1.610350190520253e-07 ] ] "source-value" [ [ -51.3935397 -13.3494581 27.3773752 ] [ -81.8541221 -222.5733043 73.132779 ] [ 133.2476618 235.9227624 -100.5101541 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.399422627418485e-17 "source-value" 87.345091 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 7.252086e-11 2.552897e-10 2.103736e-10 ] [ 2.233995e-10 7.543773000000001e-11 1.621303e-10 ] [ 2.802525e-10 2.605839e-10 1.06853e-10 ] ] "source-value" [ [ 0.7252086 2.552897 2.103736 ] [ 2.233995 0.7543773 1.621303 ] [ 2.802525 2.605839 1.06853 ] ] } "instance-id" 1 }