{ "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" [ [ 1.982478 1.406412 2.920232 ] [ 1.664708 2.759694 5.087468 ] [ 1.282886 3.129979 1.519732 ] [ 2.3658 4.253432 3.372825 ] [ 3.481612 3.001234 2.026348 ] [ 4.008994 2.747584 4.108071 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.982478e-10 1.406412e-10 2.920232e-10 ] [ 1.664708e-10 2.759694e-10 5.087468e-10 ] [ 1.282886e-10 3.129979e-10 1.519732e-10 ] [ 2.3658e-10 4.253432e-10 3.372825e-10 ] [ 3.481612e-10 3.001234e-10 2.026348e-10 ] [ 4.008994e-10 2.747584e-10 4.108071e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6237733 -4.8153216 1.5139417 ] [ 0.3161381 -0.8327823 0.131312 ] [ -2.8952349 0.8983792 -1.6421972 ] [ -3.0672935 8.3651357 3.0255099 ] [ 5.0709358 -1.6774757 -7.800609 ] [ 1.1992278 -1.9379352 4.7720426 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.993949979392645e-10 -7.714995689153249e-09 2.425601996994207e-09 ] [ 5.065090727641324e-10 -1.334264331276052e-09 2.103850164304896e-10 ] [ -4.638677668504226e-09 1.439362150853007e-09 -2.631089960583222e-09 ] [ -4.914345934831804e-09 1.340242484835944e-08 4.847401227778946e-09 ] [ 8.124534784337744e-09 -2.687612348500114e-09 -1.249795336780207e-08 ] [ 1.921374744173419e-09 -3.104914470065373e-09 7.645655087181646e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.965631 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.557976072451973e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0714817 1.3954813 3.0298919 ] [ 1.6511294 2.7162565 5.0691603 ] [ 1.2059957 3.1707278 1.5536763 ] [ 2.2953443 4.4034196 3.3904005 ] [ 3.6277865 2.9629145 1.783686 ] [ 3.9347403 2.6495353 4.2078609 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0714817e-10 1.3954813e-10 3.0298919e-10 ] [ 1.6511294e-10 2.7162565e-10 5.0691603e-10 ] [ 1.2059957e-10 3.1707278e-10 1.5536763e-10 ] [ 2.2953443e-10 4.4034196e-10 3.3904005e-10 ] [ 3.6277865e-10 2.9629145e-10 1.783686e-10 ] [ 3.9347403e-10 2.6495353e-10 4.2078609e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.62e-05 -0.0001246 -1.47e-05 ] [ 2e-07 2.4e-06 3.41e-05 ] [ -8.3e-06 -8.1e-06 -1.68e-05 ] [ 6e-06 0.0001283 8.2e-06 ] [ 2e-05 1.86e-05 -1.93e-05 ] [ -1.8e-06 -1.66e-05 8.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.595526125696e-14 -1.9963120695168e-13 -2.355199632576e-14 ] [ 3.2043532416e-16 3.84522388992e-15 5.463422276928e-14 ] [ -1.329806595264e-14 -1.297763062848e-14 -2.691656722944e-14 ] [ 9.6130597248e-15 2.0555926044864e-13 1.313784829056e-14 ] [ 3.2043532416e-14 2.980048514688e-14 -3.092200878144e-14 ] [ -2.88391791744e-15 -2.659613190528e-14 1.377871893888e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.293287 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.930907674898457e-18 } }