{ "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" [ [ 2.682391 2.686577 1.562325 ] [ 1.212844 1.781832 3.455784 ] [ 1.883235 4.08794 3.099932 ] [ 4.668223 1.307552 1.415877 ] [ 3.293332 1.297731 3.803317 ] [ 4.485506 3.146522 2.925064 ] [ 3.343094 3.696236 5.003524 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.682391e-10 2.686577e-10 1.562325e-10 ] [ 1.212844e-10 1.781832e-10 3.455784e-10 ] [ 1.883235e-10 4.08794e-10 3.099932e-10 ] [ 4.668223000000001e-10 1.307552e-10 1.415877e-10 ] [ 3.293332e-10 1.297731e-10 3.803317e-10 ] [ 4.485506e-10 3.146522e-10 2.925064e-10 ] [ 3.343094e-10 3.696236e-10 5.003524e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.3097681 -0.6250578 2.7372226 ] [ -0.5224647 1.1763616 -0.1748142 ] [ 4.0020447 -3.5139522 3.7723438 ] [ -4.3866129 7.556195 4.1891403 ] [ 3.171043 3.727849 -1.6500222 ] [ -6.3202953 -8.1500733 1.1349018 ] [ -1.253483 -0.1713223 -10.0087721 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.507186311689637e-09 -1.001452993808682e-09 4.38551405564539e-09 ] [ -8.370807275332858e-10 1.884739053126881e-09 -2.800832242238554e-10 ] [ 6.41198245373655e-09 -5.629972061448726e-09 6.043961041979831e-09 ] [ -7.02812863287969e-09 1.210635897120586e-08 6.711742649911098e-09 ] [ 5.080570958151494e-09 5.972672513672659e-09 -2.643626992640982e-09 ] [ -1.012622936621212e-08 -1.305785689906631e-08 1.818313130863837e-09 ] [ -2.008301157170246e-09 -2.744885836816838e-10 -1.603582066153532e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -8.4941399 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.360911236158445e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6068895 3.2166775 0.9729667 ] [ 0.9339611 0.6742197 3.9991801 ] [ 2.0910635 4.475591 2.7168244 ] [ 4.5602215 2.2545571 1.3947892 ] [ 3.1034611 0.8367979 4.3544223 ] [ 4.5822319 2.299112 3.6115921 ] [ 3.6907965 4.2474348 4.2160482 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6068895e-10 3.2166775e-10 9.729667e-11 ] [ 9.339611e-11 6.742197e-11 3.9991801e-10 ] [ 2.0910635e-10 4.475591e-10 2.7168244e-10 ] [ 4.5602215e-10 2.2545571e-10 1.3947892e-10 ] [ 3.1034611e-10 8.367979e-11 4.354422300000001e-10 ] [ 4.5822319e-10 2.299112e-10 3.6115921e-10 ] [ 3.6907965e-10 4.2474348e-10 4.2160482e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.5801314 0.0397583 0.1623183 ] [ 0.4742984 -0.1762792 0.2320391 ] [ -0.4027151 0.1143581 -0.7431744 ] [ -0.6140903 0.2239676 -0.4237247 ] [ -0.6316995 -0.2944176 0.0625808 ] [ 0.0753048 0.246096 0.2815333 ] [ 0.5187703 -0.1534832 0.4284275 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.294729660719731e-10 6.369981874275265e-11 2.600625853880006e-10 ] [ 7.599098077628468e-10 -2.824304129733274e-10 3.717676211314733e-10 ] [ -6.45220718063134e-10 1.832218742191085e-10 -1.190696648857068e-09 ] [ -9.838811217200581e-10 3.588356525366861e-10 -6.788818079954938e-10 ] [ -1.01209417027105e-09 -4.717089954720461e-10 1.002654946709607e-10 ] [ 1.206515899940198e-10 3.942892576723968e-10 4.510660712366726e-10 ] [ 8.311616462254024e-10 -2.459071947255706e-10 6.864165242077921e-10 ] ] } "relaxed-potential-energy" { "source-value" -15.366184 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.461934075571103e-18 } }