{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.9376576e-10 5.871424e-11 2.5046319e-10 ] [ 1.7050232e-10 2.2826527e-10 3.1900871e-10 ] [ 1.5861079e-10 2.7540082e-10 5.348647200000001e-10 ] [ 3.5774225e-10 2.6610594e-10 2.0875602e-10 ] [ 2.8205706e-10 1.0535371e-10 4.6576037e-10 ] [ 4.6905269e-10 1.4340391e-10 3.5505429e-10 ] [ 3.4620392e-10 3.132248e-10 4.2387022e-10 ] ] "source-value" [ [ 2.9376576 0.5871424 2.5046319 ] [ 1.7050232 2.2826527 3.1900871 ] [ 1.5861079 2.7540082 5.3486472 ] [ 3.5774225 2.6610594 2.0875602 ] [ 2.8205706 1.0535371 4.6576037 ] [ 4.6905269 1.4340391 3.5505429 ] [ 3.4620392 3.132248 4.2387022 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.82391786511872e-11 -3.44179581680256e-11 -1.520641852567488e-11 ] [ 6.135887848210177e-11 3.465924596711808e-11 2.479919469445555e-10 ] [ 1.143100147112314e-10 -5.905687111333633e-11 -1.729666621046919e-10 ] [ 3.678469347227136e-11 -1.727915442000384e-11 -7.553285439333313e-11 ] [ -4.851262633652736e-11 1.837914480078029e-10 -6.9646617706176e-11 ] [ -1.209034521588096e-11 1.156547215490688e-11 5.77472519434944e-12 ] [ -1.700897937643834e-10 -1.192620222108e-10 7.958588059097088e-11 ] ] "source-value" [ [ 0.011384 -0.021482 -0.0094911 ] [ 0.0382972 0.0216326 0.1547844 ] [ 0.0713467 -0.0368604 -0.1079573 ] [ 0.0229592 -0.0107848 -0.0471439 ] [ -0.0302792 0.1147136 -0.04347 ] [ -0.0075462 0.0072186 0.0036043 ] [ -0.1061617 -0.0744375 0.0496736 ] ] } "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" -8.093789014984593e-18 "source-value" -50.517458 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.845709497778953e-08 -5.456235136911818e-08 1.930120786019872e-08 ] [ 1.216439942147096e-08 -4.815462317496284e-09 -1.765343313255309e-08 ] [ 5.948980647327904e-09 1.003883976395422e-09 1.398867617415274e-08 ] [ 2.701820643034564e-08 5.957797841838087e-08 -1.716076798731631e-09 ] [ 2.066085098958357e-09 6.910903618024574e-09 -6.82161896125959e-09 ] [ -1.267292291090042e-08 5.358059297120303e-09 -3.200867546143788e-09 ] [ -6.067653549195236e-09 -1.347301178352437e-08 -3.897887595663359e-09 ] ] "source-value" [ [ -17.7615218 -34.0551414 12.0468665 ] [ 7.592421 -3.0055752 -11.0184064 ] [ 3.7130617 0.6265751 8.731045 ] [ 16.8634382 37.1856496 -1.0710909 ] [ 1.2895489 4.3134468 -4.2577197 ] [ -7.9098164 3.3442376 -1.9978244 ] [ -3.7871315 -8.4091926 -2.4328701 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.605057914728683e-18 "source-value" -28.742511 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.719922e-10 6.324478999999999e-11 2.001085e-10 ] [ 1.570016e-10 2.535953e-10 2.950979e-10 ] [ 1.512501e-10 2.471908e-10 5.050939e-10 ] [ 3.556391e-10 2.380181e-10 1.668166e-10 ] [ 3.168972e-10 1.023761e-10 5.396195e-10 ] [ 4.64835e-10 1.331065e-10 3.67677e-10 ] [ 3.603196e-10 3.529371e-10 4.833641e-10 ] ] "source-value" [ [ 2.719922 0.6324479 2.001085 ] [ 1.570016 2.535953 2.950979 ] [ 1.512501 2.471908 5.050939 ] [ 3.556391 2.380181 1.668166 ] [ 3.168972 1.023761 5.396195 ] [ 4.64835 1.331065 3.67677 ] [ 3.603196 3.529371 4.833641 ] ] } "instance-id" 1 }