{ "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" [ [ 1.222424 2.904477 0.9358623 ] [ 1.494107 1.000567 2.599919 ] [ 2.753047 4.765039 1.902757 ] [ 2.502796 3.18307 3.733295 ] [ 3.53967 2.110225 1.931082 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.222424e-10 2.904477e-10 9.358623e-11 ] [ 1.494107e-10 1.000567e-10 2.599919e-10 ] [ 2.753047e-10 4.765039e-10 1.902757e-10 ] [ 2.502796e-10 3.18307e-10 3.733295e-10 ] [ 3.53967e-10 2.110225e-10 1.931082e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8468825 0.1951679 0.6441369 ] [ -0.007193 1.3232958 -0.4962584 ] [ -1.1341449 -1.7103092 0.1222659 ] [ -0.0702044 0.5708253 0.3552705 ] [ 0.3646598 -0.3789798 -0.625415 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.356855342064656e-09 3.126934465106323e-10 1.032021081774588e-09 ] [ -1.15244564334144e-11 2.120153593162833e-09 -7.950936063556146e-10 ] [ -1.817100443379554e-09 -2.740217414579151e-09 1.958915665010707e-10 ] [ -1.124798483572915e-10 9.145629502211462e-10 5.692060891599263e-10 ] [ 5.842494061056039e-10 -6.071925753154598e-10 -1.002025291297632e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.735797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.040499620065478e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9598981 3.0334438 1.0338921 ] [ 1.7532147 1.3782064 2.5549195 ] [ 2.8516157 4.2071422 1.886248 ] [ 2.0829353 3.285737 3.9460582 ] [ 3.8643803 2.0588486 1.6817975 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.598981e-11 3.0334438e-10 1.0338921e-10 ] [ 1.7532147e-10 1.3782064e-10 2.5549195e-10 ] [ 2.8516157e-10 4.2071422e-10 1.886248e-10 ] [ 2.0829353e-10 3.285737e-10 3.9460582e-10 ] [ 3.8643803e-10 2.0588486e-10 1.6817975e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.87e-05 -1.48e-05 -4.44e-05 ] [ -6.94e-05 -5.33e-05 -3e-07 ] [ -1.1e-06 4.74e-05 -3.1e-06 ] [ 4.6e-05 1.36e-05 4.34e-05 ] [ 4.32e-05 7e-06 4.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.996070280896e-14 -2.371221398784e-14 -7.113664196352e-14 ] [ -1.1119105748352e-13 -8.539601388864e-14 -4.8065298624e-16 ] [ -1.76239428288e-15 7.594317182591999e-14 -4.96674752448e-15 ] [ 7.37001245568e-14 2.178960204288e-14 6.953446534272e-14 ] [ 6.921403001856e-14 1.12152363456e-14 7.04957713152e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.103084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.259563146597855e-18 } }