{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.5859093e-10 5.943575e-11 1.2228426e-10 ] [ 1.8059222e-10 2.5768166e-10 2.8213407e-10 ] [ 2.5158138e-10 1.614774e-11 3.7854697e-10 ] [ 2.444322e-10 2.3444806e-10 5.2394738e-10 ] [ 4.857430500000001e-10 7.781384000000001e-11 2.6009177e-10 ] [ 3.9154964e-10 2.8266173e-10 1.4165236e-10 ] [ 4.6074488e-10 1.0714548e-10 5.0829729e-10 ] ] "source-value" [ [ 2.5859093 0.5943575 1.2228426 ] [ 1.8059222 2.5768166 2.8213407 ] [ 2.5158138 0.1614774 3.7854697 ] [ 2.444322 2.3444806 5.2394738 ] [ 4.8574305 0.7781384 2.6009177 ] [ 3.9154964 2.8266173 1.4165236 ] [ 4.6074488 1.0714548 5.0829729 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.58166876005376e-12 -1.09332532603392e-12 -1.4195284860288e-13 ] [ 2.00768752352448e-12 1.81654785266304e-12 5.1141477735936e-13 ] [ 6.597763324454399e-13 -1.0045647412416e-13 -7.305925390848e-13 ] [ 2.04966455098944e-12 -1.686290893392e-12 1.01065301240064e-12 ] [ 1.70968267205568e-12 4.14050504113344e-12 1.94968872985152e-12 ] [ -1.19458288846848e-12 -1.69622438844096e-12 -3.5872734539712e-12 ] [ -3.65071964815488e-12 -1.38075581180544e-12 9.8806232204736e-13 ] ] "source-value" [ [ -0.0009872 -0.0006824 -8.86e-05 ] [ 0.0012531 0.0011338 0.0003192 ] [ 0.0004118 -6.27e-05 -0.000456 ] [ 0.0012793 -0.0010525 0.0006308 ] [ 0.0010671 0.0025843 0.0012169 ] [ -0.0007456 -0.0010587 -0.002239 ] [ -0.0022786 -0.0008618 0.0006167 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.640007675654595e-18 "source-value" -16.477632 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.941205004089279e-09 -5.472781551876066e-09 -3.087635956516017e-09 ] [ -1.452469782092499e-08 1.64755886638951e-08 5.041862370992966e-10 ] [ -6.770434705407879e-10 -8.035525701951538e-09 3.737303515790181e-09 ] [ 5.191834113582951e-10 -1.145023560145584e-09 -1.387449064856494e-09 ] [ 1.171025252481015e-08 -8.892978906306606e-09 -4.91272869775077e-09 ] [ 4.254280089070987e-09 6.031983009345068e-09 -3.33206129808501e-09 ] [ 2.659230110097967e-09 1.038738047039629e-09 8.478385264318812e-09 ] ] "source-value" [ [ -2.4599067 -3.4158416 -1.9271508 ] [ -9.0656034 10.2832537 0.3146883 ] [ -0.4225773 -5.0153807 2.3326414 ] [ 0.3240488 -0.7146675 -0.8659776 ] [ 7.3089648 -5.5505609 -3.0662841 ] [ 2.6553128 3.7648677 -2.0797091 ] [ 1.6597609 0.6483293 5.2917919 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.057850712215756e-18 "source-value" -12.844094 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.69276e-10 7.489354e-11 1.12344e-10 ] [ 2.32609e-10 2.279725e-10 3.013569e-10 ] [ 2.388377e-10 2.175567e-11 3.770382e-10 ] [ 2.168931e-10 2.205605e-10 5.63033e-10 ] [ 4.690190000000001e-10 7.206414e-11 2.589749e-10 ] [ 3.957875e-10 2.675588e-10 1.380487e-10 ] [ 4.50812e-10 1.505291e-10 4.661584000000001e-10 ] ] "source-value" [ [ 2.69276 0.7489354 1.12344 ] [ 2.32609 2.279725 3.013569 ] [ 2.388377 0.2175567 3.770382 ] [ 2.168931 2.205605 5.63033 ] [ 4.69019 0.7206414 2.589749 ] [ 3.957875 2.675588 1.380487 ] [ 4.50812 1.505291 4.661584 ] ] } "instance-id" 1 }