{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.602926 0.6959513 1.72871 ] [ 2.385594 2.93195 2.226905 ] [ 4.246813 2.107335 1.268583 ] [ 3.789163 4.485736 1.796035 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.602926e-10 6.959513e-11 1.72871e-10 ] [ 2.385594e-10 2.93195e-10 2.226905e-10 ] [ 4.246813000000001e-10 2.107335e-10 1.268583e-10 ] [ 3.789163e-10 4.485736e-10 1.796035e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0378904 -1.0295302 0.2610466 ] [ -2.7263125 -1.7543043 1.017139 ] [ 1.5203644 1.9007919 -0.370243 ] [ 2.2438385 0.8830425 -0.9079426 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.66288373383276e-09 -1.649489216847548e-09 4.182427594593293e-10 ] [ -4.368034148494801e-09 -2.81070533522891e-09 1.629636325903891e-09 ] [ 2.43589229677662e-09 3.045404343186011e-09 -5.931946786148544e-10 ] [ 3.595025585550941e-09 1.414790048672784e-09 -1.454684406748366e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.651313 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.026963791102311e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5518075 1.5778045 1.0091768 ] [ 2.5980314 2.7708024 2.9912752 ] [ 4.5775702 2.1040267 1.9958227 ] [ 3.2970868 3.7683387 1.0239583 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5518075e-10 1.5778045e-10 1.0091768e-10 ] [ 2.5980314e-10 2.7708024e-10 2.9912752e-10 ] [ 4.5775702e-10 2.1040267e-10 1.9958227e-10 ] [ 3.297086800000001e-10 3.7683387e-10 1.0239583e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.19e-05 2.32e-05 8.1e-06 ] [ -6.3e-06 -3e-07 -3.3e-06 ] [ 4e-07 -2.6e-06 -6.6e-06 ] [ -6e-06 -2.03e-05 1.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.906590178752e-14 3.717049760256e-14 1.297763062848e-14 ] [ -1.009371271104e-14 -4.8065298624e-16 -5.28718284864e-15 ] [ 6.408706483200001e-16 -4.16565921408e-15 -1.057436569728e-14 ] [ -9.6130597248e-15 -3.252418540224e-14 2.88391791744e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.70586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.516356170155789e-18 } }