{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.55675 2.192965 3.527099 ] [ 1.806278 5.26626 2.450306 ] [ 0.8031725 3.384297 2.630387 ] [ 2.570894 3.149532 1.167105 ] [ 2.627788 4.286276 4.286712 ] [ 4.842075 2.861339 2.293967 ] [ 3.90768 5.002934 2.246314 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.55675e-10 2.192965e-10 3.527099e-10 ] [ 1.806278e-10 5.26626e-10 2.450306e-10 ] [ 8.031725e-11 3.384297e-10 2.630387e-10 ] [ 2.570894e-10 3.149532e-10 1.167105e-10 ] [ 2.627788e-10 4.286276e-10 4.286712e-10 ] [ 4.842075000000001e-10 2.861339e-10 2.293967e-10 ] [ 3.90768e-10 5.002934e-10 2.246314e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.474482 -7.6773858 1.4060855 ] [ -5.2062289 9.7306089 -2.7595039 ] [ -8.3108122 -3.4799853 0.1801001 ] [ 1.9356638 -2.9287201 -6.3005581 ] [ 1.2397541 3.5646915 9.2779194 ] [ 1.5392858 -2.9158086 -0.4909012 ] [ 6.3278553 3.7065994 -1.3131418 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.964557208990426e-09 -1.23005280376219e-08 2.252797314945878e-09 ] [ -8.341298226113302e-09 1.559015408572841e-08 -4.421212633586421e-09 ] [ -1.331538900669942e-08 -5.575551088387674e-09 2.885521696237421e-10 ] [ 3.101275286088887e-09 -4.692326873087038e-09 -1.009460688581207e-08 ] [ 1.986305034560946e-09 5.711265381664483e-09 1.486486555234676e-08 ] [ 2.466207721489425e-09 -4.671640369647578e-09 -7.865104257626649e-10 ] [ 1.013834182146537e-08 5.938626901351308e-09 -2.103885091755229e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.685615 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.872241915266979e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.619479 2.2856941 3.4986773 ] [ 1.6317184 5.4434989 2.5810624 ] [ 0.5626951 3.2388864 2.373579 ] [ 2.5518424 2.6475587 0.9040776 ] [ 2.8843624 4.5122766 4.5567189 ] [ 4.7284986 2.8225028 2.206913 ] [ 4.1360416 5.1931855 2.4808619 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.619479e-10 2.2856941e-10 3.4986773e-10 ] [ 1.6317184e-10 5.4434989e-10 2.5810624e-10 ] [ 5.626951e-11 3.2388864e-10 2.373579e-10 ] [ 2.5518424e-10 2.6475587e-10 9.040776000000001e-11 ] [ 2.8843624e-10 4.5122766e-10 4.5567189e-10 ] [ 4.7284986e-10 2.8225028e-10 2.206913e-10 ] [ 4.136041600000001e-10 5.193185500000001e-10 2.4808619e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-07 2.4e-05 8.1e-06 ] [ -2.35e-05 -2.23e-05 -2.27e-05 ] [ -5e-07 6.8e-06 -3.1e-06 ] [ 6e-07 1.13e-05 2.74e-05 ] [ 6.1e-06 -3.25e-05 -5.3e-06 ] [ -1.7e-05 2.13e-05 -8.3e-06 ] [ 3.45e-05 -8.6e-06 3.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-16 3.84522388992e-14 1.297763062848e-14 ] [ -3.76511505888e-14 -3.572853864384e-14 -3.636940929216e-14 ] [ -8.010883104e-16 1.089480102144e-14 -4.96674752448e-15 ] [ 9.6130597248e-16 1.810459581504e-14 4.389963940992e-14 ] [ 9.77327738688e-15 -5.207074017599999e-14 -8.491536090240001e-15 ] [ -2.72370025536e-14 3.412636202304e-14 -1.329806595264e-14 ] [ 5.52750934176e-14 -1.377871893888e-14 6.24848882112e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.641115 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.826418201784419e-18 } }