{ "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" [ [ 0.099853 0.7165901 0.5986145 ] [ 0.2043706 1.471965 2.579922 ] [ 1.736021 0.3195483 2.600696 ] [ 1.725047 2.389347 1.166635 ] [ 1.83697 2.73027 2.853175 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.9853e-12 7.165901e-11 5.986145000000001e-11 ] [ 2.043706e-11 1.471965e-10 2.579922e-10 ] [ 1.736021e-10 3.195483e-11 2.600696e-10 ] [ 1.725047e-10 2.389347e-10 1.166635e-10 ] [ 1.83697e-10 2.73027e-10 2.853175e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.6192302 -3.6078713 -8.9097716 ] [ -17.4914852 -0.7160399 8.6508979 ] [ 9.4314701 -17.1049633 6.990225 ] [ 7.1319126 8.9897394 -21.3609536 ] [ 6.5473327 12.4391352 14.6296023 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.002999253333306e-09 -5.780447047715303e-09 -1.427502775418781e-08 ] [ -2.802444865050921e-08 -1.14722238733997e-09 1.386026636430782e-08 ] [ 1.511088089399424e-08 -2.740517229890202e-08 1.119957506913168e-08 ] [ 1.142658362930894e-08 1.440315029376462e-08 -3.422402045591359e-08 ] [ 1.048998338053934e-08 1.992969160041033e-08 2.343920677666191e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 9.9384114 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.59230903929722e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3900791 0.5859372 0.8316759 ] [ -0.5620422 1.8536391 2.7758189 ] [ 2.1711518 0.0443155 2.51326 ] [ 1.7522461 2.6786777 0.5903456 ] [ 1.8508268 2.4651509 3.087942 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.900791e-11 5.859372e-11 8.316759e-11 ] [ -5.620422000000001e-11 1.8536391e-10 2.7758189e-10 ] [ 2.1711518e-10 4.43155e-12 2.51326e-10 ] [ 1.7522461e-10 2.6786777e-10 5.903456000000001e-11 ] [ 1.8508268e-10 2.4651509e-10 3.087942e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3e-07 -6e-06 -7.3e-06 ] [ -1.03e-05 -2e-07 1.23e-05 ] [ -1.4e-06 9.7e-06 -4e-07 ] [ 9.2e-06 1.1e-06 -8.3e-06 ] [ 2.8e-06 -4.6e-06 3.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.8065298624e-16 -9.6130597248e-15 -1.169588933184e-14 ] [ -1.650241919424e-14 -3.2043532416e-16 1.970677243584e-14 ] [ -2.24304726912e-15 1.554111322176e-14 -6.408706483200001e-16 ] [ 1.474002491136e-14 1.76239428288e-15 -1.329806595264e-14 ] [ 4.48609453824e-15 -7.370012455680001e-15 5.928053496960001e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.9990301 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.121368239449549e-18 } }