{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0587563 2.624587 0.4359975 ] [ 0.6130103 1.606213 2.369845 ] [ 2.872214 1.39186 0.7464612 ] [ 1.941337 0.0175427 2.118778 ] [ 2.055015 2.698548 0.547582 ] [ 2.796139 2.772611 2.055467 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.87563e-12 2.624587e-10 4.359975e-11 ] [ 6.130103e-11 1.606213e-10 2.369845e-10 ] [ 2.872214e-10 1.39186e-10 7.464612e-11 ] [ 1.941337e-10 1.75427e-12 2.118778e-10 ] [ 2.055015e-10 2.698548e-10 5.47582e-11 ] [ 2.796139e-10 2.772611e-10 2.055467e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.9344728 0.5162712 -1.7161641 ] [ -3.3837836 3.2019771 3.3457951 ] [ 27.5476121 -49.9220188 -7.1747994 ] [ 1.71389 -6.7526224 0.9596523 ] [ -31.000011 39.0107054 -35.8259404 ] [ 13.0567653 13.9456875 40.4114565 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.271242692326855e-08 8.271576534471407e-10 -2.749598021129639e-09 ] [ -5.421419018432402e-09 5.130132892223082e-09 5.360554731371693e-09 ] [ 4.413614042911566e-08 -7.99838920434687e-08 -1.149529595231722e-08 ] [ 2.74595451124626e-09 -1.0818893827505e-08 1.537532491824358e-09 ] [ -4.966749327794297e-08 6.250204066773762e-08 -5.739948459995661e-08 ] [ 2.0919244279282e-08 2.234345465756587e-08 6.474629135020741e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 12.827989 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.055270423700902e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1109132 2.7918384 1.5691359 ] [ -0.4962943 0.5536225 1.6949266 ] [ 3.2214512 0.7374507 1.2071162 ] [ 1.4327906 -0.7204679 1.4703791 ] [ 2.4119778 2.9151902 1.2670398 ] [ 3.6556331 4.8337279 1.0655331 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.109132e-11 2.7918384e-10 1.5691359e-10 ] [ -4.962943e-11 5.536225e-11 1.6949266e-10 ] [ 3.2214512e-10 7.374507e-11 1.2071162e-10 ] [ 1.4327906e-10 -7.204679000000001e-11 1.4703791e-10 ] [ 2.4119778e-10 2.9151902e-10 1.2670398e-10 ] [ 3.6556331e-10 4.833727900000001e-10 1.0655331e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.91e-05 -6.9e-06 1.68e-05 ] [ 2.29e-05 -1.35e-05 -2.17e-05 ] [ 3.1e-06 -1.1e-06 -5.6e-06 ] [ -1.13e-05 3.2e-05 1.31e-05 ] [ -5.2e-06 7.7e-06 3.4e-06 ] [ 9.5e-06 -1.81e-05 -6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.06015737094e-14 -1.10550187746e-14 2.691656745119999e-14 ] [ 3.66898449186e-14 -2.162938455899999e-14 -3.476723295779999e-14 ] [ 4.9667475654e-15 -1.7623942974e-15 -8.972189150399999e-15 ] [ -1.81045959642e-14 5.126965228799999e-14 2.09885139054e-14 ] [ -8.331318496799998e-15 1.23367600818e-14 5.4474005556e-15 ] [ 1.5220678023e-14 -2.899939707539999e-14 -9.613059803999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.100622 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.419386372726635e-18 } }