{ "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" [ [ 0.3527209 0.4565602 1.167471 ] [ 0.6414148 2.926013 0.4472085 ] [ 0.2560781 2.125953 2.651252 ] [ 2.793307 0.1807352 2.367537 ] [ 2.546309 2.149048 0.8335699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.527209e-11 4.565602e-11 1.167471e-10 ] [ 6.414148e-11 2.926013000000001e-10 4.472085e-11 ] [ 2.560781e-11 2.125953e-10 2.651252e-10 ] [ 2.793307e-10 1.807352e-11 2.367537e-10 ] [ 2.546309e-10 2.149048e-10 8.335699e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7867805 -0.44098 0.3572404 ] [ -2.4325793 0.4910511 0.0705776 ] [ 0.4264812 0.3567765 -0.0489871 ] [ -2.3013206 1.5826379 -1.6704211 ] [ 2.5206382 -1.9894855 1.2915902 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.862737967186837e-09 -7.065278520613199e-10 5.723622216008136e-10 ] [ -3.897421714812076e-09 7.867505985199973e-10 1.130777816037984e-10 ] [ 6.832982134802807e-10 5.71618971860301e-10 -7.848598698742138e-11 ] [ -3.68712209266286e-09 2.535665463462828e-09 -2.676309655360577e-09 ] [ 4.038507626807819e-09 -3.187507181781807e-09 2.069355639143387e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.952418 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.075206147340101e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1576139 0.3563415 1.1763126 ] [ 0.5677553 2.4996999 0.2757154 ] [ 0.8068717 2.1664761 2.6858945 ] [ 2.3237514 0.3361734 2.1147786 ] [ 2.7338375 2.4796184 1.2143373 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.576139e-11 3.563415e-11 1.1763126e-10 ] [ 5.677553e-11 2.4996999e-10 2.757154e-11 ] [ 8.068717e-11 2.1664761e-10 2.6858945e-10 ] [ 2.3237514e-10 3.361734000000001e-11 2.1147786e-10 ] [ 2.7338375e-10 2.4796184e-10 1.2143373e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.9e-06 -2.2e-05 -2.91e-05 ] [ -1.16e-05 4.51e-05 6.6e-06 ] [ -5.43e-05 1.07e-05 3.79e-05 ] [ 4.14e-05 -2.6e-05 4.63e-05 ] [ 3.43e-05 -7.8e-06 -6.17e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.58615486766e-14 -3.5247885948e-14 -4.66233400494e-14 ] [ -1.85852489544e-14 7.225816619339999e-14 1.05743657844e-14 ] [ -8.69981912262e-14 1.71432899838e-14 6.072249442859999e-14 ] [ 6.633011264759999e-14 -4.165659248399999e-14 7.41807781542e-14 ] [ 5.49546585462e-14 -1.24969777452e-14 -9.885429831779999e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971627206706e-18 } }