{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.201304 1.645112 1.368441 ] [ 2.96083 0.196256 2.000233 ] [ 1.817638 2.196428 3.68098 ] [ 1.740873 3.89811 0.9150282 ] [ 4.00836 2.276208 0.7214657 ] [ 3.949621 2.27126 3.236775 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.201304e-10 1.645112e-10 1.368441e-10 ] [ 2.96083e-10 1.96256e-11 2.000233e-10 ] [ 1.817638e-10 2.196428e-10 3.68098e-10 ] [ 1.740873e-10 3.89811e-10 9.150282e-11 ] [ 4.00836e-10 2.276208e-10 7.214657e-11 ] [ 3.949621e-10 2.27126e-10 3.236775e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.2713708 -0.1466305 -0.6189169 ] [ 1.4648984 -3.8614923 -1.3464013 ] [ -3.7421238 1.6951174 2.3137094 ] [ 1.2636508 -0.292232 -0.3275062 ] [ 0.3672254 1.5936366 -0.7168453 ] [ 3.91772 1.0116009 0.6959603 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.241313813727792e-09 -2.349279589962144e-10 -9.916141873980115e-10 ] [ 2.347025968327327e-09 -6.186792684459221e-09 -2.157172685074727e-09 ] [ -5.995543264499256e-09 2.715877467791282e-09 3.706971108005195e-09 ] [ 2.024591768615217e-09 -4.682072782496256e-10 -5.24722776807049e-10 ] [ 5.883599504439283e-10 2.553287302571201e-09 -1.148512780390362e-09 ] [ 6.276879390840576e-09 1.620763311560239e-09 1.115051321664954e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.978404 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.91915188432972e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9622965 1.5515942 1.7555358 ] [ 3.0227946 0.3296463 1.5327079 ] [ 1.712542 2.5561832 3.7738956 ] [ 1.8809007 3.4176075 0.606631 ] [ 4.1148049 2.6455151 0.9088098 ] [ 3.9852874 1.9828276 3.3453428 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.622965e-11 1.5515942e-10 1.7555358e-10 ] [ 3.0227946e-10 3.296463e-11 1.5327079e-10 ] [ 1.712542e-10 2.5561832e-10 3.7738956e-10 ] [ 1.8809007e-10 3.4176075e-10 6.06631e-11 ] [ 4.1148049e-10 2.6455151e-10 9.088098e-11 ] [ 3.9852874e-10 1.9828276e-10 3.3453428e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.63e-05 -1.18e-05 2.5e-05 ] [ 2.46e-05 3.7e-06 2.42e-05 ] [ -1e-07 -1.47e-05 -2.45e-05 ] [ 5.3e-06 3.63e-05 -9.6e-06 ] [ 8e-06 -1.04e-05 1.59e-05 ] [ -1.5e-06 -3.1e-06 -3.11e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.815901133504e-14 -1.890568412544e-14 4.005441552e-14 ] [ 3.941354487168e-14 5.928053496960001e-15 3.877267422336e-14 ] [ -1.6021766208e-16 -2.355199632576e-14 -3.92533272096e-14 ] [ 8.491536090240001e-15 5.815901133504e-14 -1.538089555968e-14 ] [ 1.28174129664e-14 -1.666263685632e-14 2.547460827072e-14 ] [ -2.4032649312e-15 -4.96674752448e-15 -4.982769290688e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.144373 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.266178373647476e-18 } }