{ "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" [ [ 2.166449 2.681347 1.091002 ] [ 2.041583 4.789781 2.041915 ] [ 2.132392 3.124558 3.564623 ] [ 4.758388 2.994993 0.5845722 ] [ 4.303836 3.011562 3.07876 ] [ 3.921174 5.3024 1.134071 ] [ 3.577747 5.183138 3.725421 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.166449e-10 2.681347e-10 1.091002e-10 ] [ 2.041583e-10 4.789780999999999e-10 2.041915e-10 ] [ 2.132392e-10 3.124558e-10 3.564623e-10 ] [ 4.758388e-10 2.994993e-10 5.845722e-11 ] [ 4.303836000000001e-10 3.011562e-10 3.07876e-10 ] [ 3.921174e-10 5.3024e-10 1.134071e-10 ] [ 3.577747e-10 5.183138e-10 3.725421e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.9059222 -2.4288053 -3.8728624 ] [ -6.8374322 3.1511901 -1.9890094 ] [ -3.9696148 -3.5023353 3.5644095 ] [ -1.1899487 0.3661338 0.8013228 ] [ 7.0750321 -1.4313868 1.1626127 ] [ 4.5979985 1.0937336 -2.1610571 ] [ 2.2298873 2.7514699 2.4945838 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.053623989903702e-09 -3.89137506813513e-09 -6.205009592855378e-09 ] [ -1.095477401714511e-08 5.048763105916414e-09 -3.186744359231436e-09 ] [ -6.360024026141668e-09 -5.611359735862554e-09 5.710813567857417e-09 ] [ -1.906507987091353e-09 5.866110144446631e-10 1.283860655873994e-09 ] [ 1.133545102202953e-08 -2.293334466281726e-09 1.862710886985164e-09 ] [ 7.36680569917347e-09 1.752354403303419e-09 -3.462395161833847e-09 ] [ 3.572673299078836e-09 4.408340746614914e-09 3.996763842986423e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.283251 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.288429082121822e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0867209 2.6173491 0.9970078 ] [ 1.6947727 4.985249 1.8552523 ] [ 2.1700366 2.9705197 3.5199964 ] [ 4.4723168 3.0758847 0.8708588 ] [ 4.7035857 2.8273317 3.2795892 ] [ 4.0811739 5.4658641 1.0994437 ] [ 3.6929625 5.1455807 3.598216 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0867209e-10 2.6173491e-10 9.970078e-11 ] [ 1.6947727e-10 4.985249e-10 1.8552523e-10 ] [ 2.1700366e-10 2.9705197e-10 3.5199964e-10 ] [ 4.4723168e-10 3.0758847e-10 8.708588e-11 ] [ 4.7035857e-10 2.8273317e-10 3.2795892e-10 ] [ 4.0811739e-10 5.4658641e-10 1.0994437e-10 ] [ 3.692962500000001e-10 5.1455807e-10 3.598216e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.96e-05 1.3e-06 -1.77e-05 ] [ 1.59e-05 -1.59e-05 2.14e-05 ] [ -8e-07 -2.37e-05 -8.4e-06 ] [ 3.34e-05 -1.36e-05 -1.11e-05 ] [ -6.6e-06 6e-07 4.25e-05 ] [ -6.9e-06 3.27e-05 -7.3e-06 ] [ 1.46e-05 1.86e-05 -1.95e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.946796039168e-14 2.08282960704e-15 -2.835852618816e-14 ] [ 2.547460827072e-14 -2.547460827072e-14 3.428657968511999e-14 ] [ -1.28174129664e-15 -3.797158591296e-14 -1.345828361472e-14 ] [ 5.351269913472e-14 -2.178960204288e-14 -1.778416049088e-14 ] [ -1.057436569728e-14 9.6130597248e-16 6.8092506384e-14 ] [ -1.105501868352e-14 5.239117550016001e-14 -1.169588933184e-14 ] [ 2.339177866368e-14 2.980048514688e-14 -3.12424441056e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.473824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.799615228877394e-18 } }