{ "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" [ [ 0.4314663 0.9036294 0.7794334 ] [ 1.004832 0.4139501 2.5602 ] [ 0.3021018 2.478458 1.913452 ] [ 2.709186 0.4632097 1.441964 ] [ 2.312911 2.26354 0.6044428 ] [ 2.800336 2.901369 2.552849 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.314663000000001e-11 9.036294e-11 7.794334000000001e-11 ] [ 1.004832e-10 4.139501e-11 2.5602e-10 ] [ 3.021018e-11 2.478458e-10 1.913452e-10 ] [ 2.709186e-10 4.632097e-11 1.441964e-10 ] [ 2.312911e-10 2.26354e-10 6.044428e-11 ] [ 2.800336e-10 2.901369e-10 2.552849e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.8694378 -4.1452405 -9.7532216 ] [ -1.8379882 -4.9726971 8.6990792 ] [ -3.4060782 7.8967569 4.3392601 ] [ 10.512781 -3.5170103 0.7156237 ] [ 3.9528653 3.6207936 -7.6062972 ] [ 0.6478578 1.1173974 3.6055558 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.581258263387636e-08 -6.641407471410476e-09 -1.562638375374409e-08 ] [ -2.944781747607719e-09 -7.967139101579562e-09 1.393746143155541e-08 ] [ -5.457138905616778e-09 1.265199938955827e-08 6.952261141068502e-09 ] [ 1.684333207655915e-08 -5.63487172419733e-09 1.146555570876626e-09 ] [ 6.333188421009399e-09 5.801150902456742e-09 -1.218663164509962e-08 ] [ 1.037982629314645e-09 1.790268005172351e-09 5.776737255343176e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.909056055642621 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.267170480934681e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6569518 0.6886377 0.675282 ] [ 0.710827 0.5588314 3.0065305 ] [ 0.4290525 2.6322294 1.9691821 ] [ 2.9299293 0.3250866 1.0701458 ] [ 2.191151 2.4466176 0.431584 ] [ 2.6429214 2.7727535 2.6996168 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.569518e-11 6.886377e-11 6.75282e-11 ] [ 7.10827e-11 5.588314e-11 3.0065305e-10 ] [ 4.290525e-11 2.6322294e-10 1.9691821e-10 ] [ 2.9299293e-10 3.250866e-11 1.0701458e-10 ] [ 2.191151e-10 2.4466176e-10 4.31584e-11 ] [ 2.6429214e-10 2.7727535e-10 2.6996168e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.75e-05 -5.75e-05 -1.97e-05 ] [ -1.94e-05 -9.36e-05 0.0001133 ] [ -3.98e-05 4.58e-05 2.07e-05 ] [ -3.4e-05 -0.0001168 2.34e-05 ] [ 5.29e-05 0.0001817 -0.0003139 ] [ 2.27e-05 4.03e-05 0.0001762 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.8038091095e-14 -9.212515645499998e-14 -3.15628796898e-14 ] [ -3.10822266996e-14 -1.499637329424e-13 1.815266126322e-13 ] [ -6.376663003319999e-14 7.33796898372e-14 3.316505632379999e-14 ] [ -5.447400555599999e-14 -1.871342308512e-13 3.749093323559999e-14 ] [ 8.475514393859999e-14 2.911154943978e-13 -5.029232454125999e-13 ] [ 3.636940959179999e-14 6.456771835019998e-14 2.823035229108e-13 ] ] } "relaxed-potential-energy" { "source-value" -15.38214005564262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.464490537806606e-18 } }