{ "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" [ [ 2.674789 2.922951 1.929928 ] [ 1.975006 0.6488867 2.865648 ] [ 2.721706 2.680777 4.242411 ] [ 4.506989 0.6613651 2.267837 ] [ 4.914488 1.931532 3.86875 ] [ 3.976236 4.774813 0.5862588 ] [ 4.03158 4.218687 2.874326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.674789e-10 2.922951e-10 1.929928e-10 ] [ 1.975006e-10 6.488867e-11 2.865648e-10 ] [ 2.721706e-10 2.680777e-10 4.242411e-10 ] [ 4.506989e-10 6.613651e-11 2.267837e-10 ] [ 4.914488e-10 1.931532e-10 3.86875e-10 ] [ 3.976236e-10 4.774813e-10 5.862588e-11 ] [ 4.03158e-10 4.218687e-10 2.874326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.2081612 0.1325884 -3.8505996 ] [ -1.3661394 -1.5159936 -0.3575467 ] [ -1.915848 0.2063157 3.3117706 ] [ 0.3540902 -2.606212 -2.4848727 ] [ 3.8668343 0.6520082 3.551809 ] [ 0.1782709 0.516804 -1.2079169 ] [ 2.090953 2.6144893 1.0373563 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.140040870397673e-09 2.124300346692787e-10 -6.169340655181832e-09 ] [ -2.18879660743374e-09 -2.428889503202427e-09 -5.728529635841914e-10 ] [ -3.069526874606439e-09 3.305541910439866e-10 5.306041428772789e-09 ] [ 5.673150400943962e-10 -4.17561193524841e-09 -3.981204945604172e-09 ] [ 6.195351511967534e-09 1.044632294609891e-09 5.690625341347027e-09 ] [ 2.856214681489747e-10 8.280112863359233e-10 -1.935296217049212e-09 ] [ 3.350076011791622e-09 4.188873631791757e-09 1.662028011299591e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.405044 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.628377795999532e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8614839 2.7401387 0.8941547 ] [ 2.2061547 1.0596336 2.5499439 ] [ 2.5206592 2.2423123 4.6633266 ] [ 4.5928835 0.5440606 2.508372 ] [ 4.8999429 2.3499388 4.1234688 ] [ 3.5188991 4.5633034 1.0511627 ] [ 5.2007707 4.3396244 2.8447301 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8614839e-10 2.7401387e-10 8.941547e-11 ] [ 2.2061547e-10 1.0596336e-10 2.5499439e-10 ] [ 2.5206592e-10 2.2423123e-10 4.6633266e-10 ] [ 4.5928835e-10 5.440606e-11 2.508372e-10 ] [ 4.899942900000001e-10 2.3499388e-10 4.1234688e-10 ] [ 3.5188991e-10 4.5633034e-10 1.0511627e-10 ] [ 5.2007707e-10 4.3396244e-10 2.8447301e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6e-07 -1.75e-05 1.29e-05 ] [ -1.7e-06 -6.8e-06 1.71e-05 ] [ 2.28e-05 1.15e-05 -5.52e-05 ] [ -2.01e-05 4.41e-05 -4.1e-06 ] [ -3e-06 -3.14e-05 2.13e-05 ] [ 2.3e-06 -6.4e-06 4.7e-06 ] [ 3e-07 6.5e-06 3.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.6130597248e-16 -2.8038090864e-14 2.066807840832e-14 ] [ -2.72370025536e-15 -1.089480102144e-14 2.739722021568e-14 ] [ 3.652962695424e-14 1.84250311392e-14 -8.844014946816001e-14 ] [ -3.220375007808e-14 7.065598897728e-14 -6.568924145279999e-15 ] [ -4.8065298624e-15 -5.030834589312e-14 3.412636202304e-14 ] [ 3.68500622784e-15 -1.025393037312e-14 7.53023011776e-15 ] [ 4.8065298624e-16 1.04141480352e-14 5.44740051072e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.075996 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.376746805127432e-18 } }