{ "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" [ [ 0.7955699 1.924478 0.0578634 ] [ 0.2789322 2.342777 2.34838 ] [ 2.533834 0.6960937 0.5593318 ] [ 1.694509 0.4311754 2.932881 ] [ 2.816233 2.726519 1.407602 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.955699e-11 1.924478e-10 5.786340000000001e-12 ] [ 2.789322e-11 2.342777e-10 2.34838e-10 ] [ 2.533834e-10 6.960937e-11 5.593318000000001e-11 ] [ 1.694509e-10 4.311754e-11 2.932881e-10 ] [ 2.816233e-10 2.726519e-10 1.407602e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.224935 1.1004894 -0.0223731 ] [ 1.1487695 -0.4420885 -0.3134134 ] [ 0.9124933 -2.3921 0.7562071 ] [ 0.031198 0.8524936 -1.2309118 ] [ -0.8675259 0.8812055 0.8104912 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.962562218999648e-09 1.76317838811822e-09 -3.584565775482049e-11 ] [ 1.840531635588106e-09 -7.083038590245408e-10 -5.021436221254388e-10 ] [ 1.461975431896641e-09 -3.83256669461568e-09 1.211577336102968e-09 ] [ 4.99847062157184e-11 1.365845315301627e-09 -1.972138108226846e-09 ] [ -1.389929714918479e-09 1.411846850220374e-09 1.298550052004137e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.540894 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.4899257033131e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8370297 2.0818488 -0.0039051 ] [ 0.2832793 2.3053303 2.3062476 ] [ 2.4687007 0.4303125 0.5469736 ] [ 1.9149701 0.6538084 2.8571285 ] [ 2.6150984 2.6497432 1.5996136 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.370297e-11 2.0818488e-10 -3.9051e-13 ] [ 2.832793e-11 2.3053303e-10 2.3062476e-10 ] [ 2.4687007e-10 4.303125e-11 5.469736e-11 ] [ 1.9149701e-10 6.538083999999999e-11 2.8571285e-10 ] [ 2.6150984e-10 2.6497432e-10 1.5996136e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.3e-06 -1.24e-05 1.09e-05 ] [ 4.03e-05 -3.09e-05 -9.5e-06 ] [ -1.61e-05 3.79e-05 1.52e-05 ] [ -3.3e-05 3.1e-06 6e-07 ] [ 6.6e-06 2.4e-06 -1.72e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.68500622784e-15 -1.986699009792e-14 1.746372516672e-14 ] [ 6.456771781824e-14 -4.950725758272e-14 -1.52206778976e-14 ] [ -2.579504359488e-14 6.072249392832e-14 2.435308463616e-14 ] [ -5.28718284864e-14 4.96674752448e-15 9.6130597248e-16 ] [ 1.057436569728e-14 3.84522388992e-15 -2.755743787776e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.28693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609453847060615e-18 } }