{ "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" [ [ 1.919195 1.598632 0.607522 ] [ 2.894266 0.8592219 2.792014 ] [ 2.250891 3.034774 3.11288 ] [ 5.028948 2.389792 2.243338 ] [ 4.250492 2.740815 4.381763 ] [ 4.34969 4.079675 2.747402 ] [ 3.264148 3.629997 0.8600408 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.919195e-10 1.598632e-10 6.07522e-11 ] [ 2.894266e-10 8.592219e-11 2.792014e-10 ] [ 2.250891e-10 3.034774e-10 3.11288e-10 ] [ 5.028948e-10 2.389792e-10 2.243338e-10 ] [ 4.250492000000001e-10 2.740815e-10 4.381763e-10 ] [ 4.34969e-10 4.079675e-10 2.747402e-10 ] [ 3.264148e-10 3.629997e-10 8.600408e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4010068 -3.1611219 -0.5477741 ] [ 14.633267 53.189497 -3.2743867 ] [ 140.120479 -18.2094729 -19.6395718 ] [ -94.0281553 14.8708021 32.1860857 ] [ -31.3532341 40.0300885 -110.362549 ] [ -45.5157176 -65.8886575 43.6657233 ] [ 14.7423541 -20.8311353 57.9724726 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.244660359035111e-09 -5.064675645405684e-09 -8.776308637303793e-10 ] [ 2.344507846648328e-08 8.52189692676131e-08 -5.246145861420367e-09 ] [ 2.244977573986876e-07 -2.917479199783622e-08 -3.146606303972532e-08 ] [ -1.506497133597832e-07 2.382565165345813e-08 5.156779444846152e-08 ] [ -5.023341907535201e-08 6.41352724516521e-08 -1.768202972764801e-07 ] [ -7.292421921846255e-08 -1.055652674921288e-07 6.996020157796937e-08 ] [ 2.36198552691741e-08 -3.337515823735258e-08 9.288214101492523e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 12.620787723632834 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.022073119347857e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.919195 1.598632 0.607522 ] [ 2.894266 0.8592219 2.792014 ] [ 2.250891 3.034774 3.11288 ] [ 5.028948 2.389792 2.243338 ] [ 4.250492 2.740815 4.381763 ] [ 4.34969 4.079675 2.747402 ] [ 3.264148 3.629997 0.8600408 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.919195e-10 1.598632e-10 6.07522e-11 ] [ 2.894266e-10 8.592219e-11 2.792014e-10 ] [ 2.250891e-10 3.034774e-10 3.11288e-10 ] [ 5.028948e-10 2.389792e-10 2.243338e-10 ] [ 4.250492000000001e-10 2.740815e-10 4.381763e-10 ] [ 4.34969e-10 4.079675e-10 2.747402e-10 ] [ 3.264148e-10 3.629997e-10 8.600408e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.4010068 -3.1611219 -0.5477741 ] [ 14.633267 53.189497 -3.2743867 ] [ 140.120479 -18.2094729 -19.6395718 ] [ -94.0281553 14.8708021 32.1860857 ] [ -31.3532341 40.0300885 -110.362549 ] [ -45.5157176 -65.8886575 43.6657233 ] [ 14.7423541 -20.8311353 57.9724726 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.244660359035111e-09 -5.064675645405684e-09 -8.776308637303793e-10 ] [ 2.344507846648328e-08 8.52189692676131e-08 -5.246145861420367e-09 ] [ 2.244977573986876e-07 -2.917479199783622e-08 -3.146606303972532e-08 ] [ -1.506497133597832e-07 2.382565165345813e-08 5.156779444846152e-08 ] [ -5.023341907535201e-08 6.41352724516521e-08 -1.768202972764801e-07 ] [ -7.292421921846255e-08 -1.055652674921288e-07 6.996020157796937e-08 ] [ 2.36198552691741e-08 -3.337515823735258e-08 9.288214101492523e-08 ] ] } "relaxed-potential-energy" { "source-value" 12.620787723632834 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.022073119347857e-18 } }