{ "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" [ [ 1.899847 1.906187 1.523281 ] [ 1.884769 1.70171 3.709853 ] [ 2.49478 3.91064 2.644859 ] [ 3.453021 0.2240813 2.013003 ] [ 4.505277 2.817941 2.046258 ] [ 4.372743 1.259433 3.808578 ] [ 3.775648 3.545824 4.38804 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.899847e-10 1.906187e-10 1.523281e-10 ] [ 1.884769e-10 1.70171e-10 3.709853e-10 ] [ 2.49478e-10 3.91064e-10 2.644859e-10 ] [ 3.453021e-10 2.240813e-11 2.013003e-10 ] [ 4.505277e-10 2.817941e-10 2.046258e-10 ] [ 4.372743e-10 1.259433e-10 3.808578e-10 ] [ 3.775648e-10 3.545824e-10 4.38804e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0018527 -0.3759423 -6.1416133 ] [ -3.7153874 -1.8504609 7.0892643 ] [ -3.4016937 4.1699992 -2.391957 ] [ 0.0443353 -3.0262324 -2.4484628 ] [ 5.050718 1.8465952 -4.3653805 ] [ 2.1660248 -1.7915247 3.7047645 ] [ 1.8578555 1.0275659 4.5533849 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.207321594225357e-09 -6.023259638297799e-10 -9.839949243254337e-09 ] [ -5.952706829494898e-09 -2.964765191684527e-09 1.135825352013208e-08 ] [ -5.450114117262649e-09 6.681075226994705e-09 -3.832337583358905e-09 ] [ 7.103298113615423e-11 -4.848558800387474e-09 -3.922869855058507e-09 ] [ 8.092142297853734e-09 2.958571657521501e-09 -6.994110577996214e-09 ] [ 3.470354294632996e-09 -2.870338989925734e-09 5.935687067469802e-09 ] [ 2.976612646924694e-09 1.646342061311311e-09 7.295326832283747e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.137219 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.104814514412956e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6603844 1.8862521 1.9809608 ] [ 2.2527353 1.6115492 4.3594569 ] [ 2.6790856 4.0872487 1.8478975 ] [ 3.3248839 0.1816235 1.4680916 ] [ 4.8371132 2.9861262 2.5983023 ] [ 4.4297394 0.7401397 3.577552 ] [ 3.2021431 3.8728769 4.301611 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6603844e-10 1.8862521e-10 1.9809608e-10 ] [ 2.2527353e-10 1.6115492e-10 4.3594569e-10 ] [ 2.6790856e-10 4.0872487e-10 1.8478975e-10 ] [ 3.3248839e-10 1.816235e-11 1.4680916e-10 ] [ 4.837113200000001e-10 2.9861262e-10 2.5983023e-10 ] [ 4.4297394e-10 7.401397e-11 3.577552e-10 ] [ 3.2021431e-10 3.8728769e-10 4.301611e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.88e-05 -5.4e-06 -9.9e-06 ] [ -5.7e-06 -1.5e-06 1.75e-05 ] [ 3.1e-06 -1.1e-06 9.2e-06 ] [ 3.2e-06 -3.9e-06 -1.23e-05 ] [ 8.6e-06 8.5e-06 9.2e-06 ] [ 1.1e-06 3.7e-06 3.2e-06 ] [ 8.6e-06 -2e-07 -1.69e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.012092047104e-14 -8.65175375232e-15 -1.586154854592e-14 ] [ -9.13240673856e-15 -2.4032649312e-15 2.8038090864e-14 ] [ 4.96674752448e-15 -1.76239428288e-15 1.474002491136e-14 ] [ 5.126965186560001e-15 -6.24848882112e-15 -1.970677243584e-14 ] [ 1.377871893888e-14 1.36185012768e-14 1.474002491136e-14 ] [ 1.76239428288e-15 5.928053496960001e-15 5.126965186560001e-15 ] [ 1.377871893888e-14 -3.2043532416e-16 -2.707678489152e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.446583 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.955468401624673e-18 } }