{ "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" [ [ 3.032432 2.348999 1.593337 ] [ 4.810482 1.062628 3.508091 ] [ 5.121871 3.223017 1.668157 ] [ 3.284691 4.649431 1.699114 ] [ 3.943916 3.285754 3.641374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.032432e-10 2.348999e-10 1.593337e-10 ] [ 4.810482000000001e-10 1.062628e-10 3.508091e-10 ] [ 5.121871e-10 3.223017e-10 1.668157e-10 ] [ 3.284691e-10 4.649431e-10 1.699114e-10 ] [ 3.943916e-10 3.285754e-10 3.641374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -59.2485276 -63.7480051 -36.4800539 ] [ 41.3913119 -107.3735409 -2.1085154 ] [ 79.6118651 -1.2452498 -23.982849 ] [ -30.4492309 70.7291918 -22.3021811 ] [ -31.3054185 101.637604 84.8735994 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.492660573754355e-08 -1.021355633938592e-07 -5.844748948410387e-08 ] [ 6.631619223042083e-08 -1.720313769224926e-07 -3.37821407847676e-09 ] [ 1.275522690015035e-07 -1.995110116615876e-09 -3.842475996797666e-08 ] [ -4.878504586932094e-08 1.133206575100391e-07 -3.573203315126762e-08 ] [ -5.01568096250598e-08 1.628413929229285e-07 1.359824966818249e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 81.289808 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.302406298869208e-17 } "relaxed-configuration-positions" { "source-value" [ [ 2.4338419 1.793436 1.4013841 ] [ 4.6528705 1.1105605 3.1090948 ] [ 5.9060905 3.3769328 1.6916454 ] [ 3.2045896 4.5638347 1.5950868 ] [ 3.9959994 3.7250649 4.3128619 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4338419e-10 1.793436e-10 1.4013841e-10 ] [ 4.6528705e-10 1.1105605e-10 3.1090948e-10 ] [ 5.906090500000001e-10 3.3769328e-10 1.6916454e-10 ] [ 3.2045896e-10 4.5638347e-10 1.5950868e-10 ] [ 3.9959994e-10 3.7250649e-10 4.3128619e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3e-07 -1.1e-06 2e-07 ] [ -5e-07 2.2e-06 3e-07 ] [ 2e-06 -4e-07 -3e-06 ] [ 6e-07 8e-07 -6e-07 ] [ -1.8e-06 -1.5e-06 3.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.8065298624e-16 -1.76239428288e-15 3.2043532416e-16 ] [ -8.010883104e-16 3.52478856576e-15 4.8065298624e-16 ] [ 3.2043532416e-15 -6.408706483200001e-16 -4.8065298624e-15 ] [ 9.6130597248e-16 1.28174129664e-15 -9.6130597248e-16 ] [ -2.88391791744e-15 -2.4032649312e-15 4.96674752448e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.133456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.943993953270549e-18 } }