{ "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" [ [ 2.750115 2.05781 3.008489 ] [ 2.459373 1.512643 5.182306 ] [ 3.045421 4.403069 3.012822 ] [ 1.351279 3.64529 4.777489 ] [ 4.685264 1.369475 1.888704 ] [ 3.677702 3.202643 0.9471066 ] [ 3.576002 3.111527 4.892003 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.750115e-10 2.05781e-10 3.008489e-10 ] [ 2.459373e-10 1.512643e-10 5.182306e-10 ] [ 3.045421e-10 4.403069e-10 3.012822e-10 ] [ 1.351279e-10 3.64529e-10 4.777489e-10 ] [ 4.685264e-10 1.369475e-10 1.888704e-10 ] [ 3.677702e-10 3.202643e-10 9.471066000000001e-11 ] [ 3.576002e-10 3.111527e-10 4.892003e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.3249426 -28.1490803 -22.3598835 ] [ -4.319815 -22.2163151 13.8067959 ] [ 3.1502265 20.6840077 -10.1116966 ] [ -29.3887526 18.4825135 13.7947379 ] [ 6.1123253 -5.5126167 -0.576441 ] [ 3.061841 6.7206498 -12.7876813 ] [ 26.7091173 9.9908411 18.2341685 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.531498540821966e-09 -4.509979835368185e-08 -3.582448258751168e-08 ] [ -6.921106599181153e-09 -3.559446065354602e-08 2.212092559913729e-08 ] [ 5.047219248524612e-09 3.313943356138718e-08 -1.620072388914285e-08 ] [ -4.708597233019521e-08 2.961225102332038e-08 2.210160655344369e-08 ] [ 9.793024694384347e-09 -8.832185596171648e-09 -9.235602934705728e-10 ] [ 4.905610066806892e-09 1.07676679861442e-08 -2.048812401310135e-08 ] [ 4.279272330026482e-08 1.600709203254776e-08 2.92143584704278e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 20.218776 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.239405020839214e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6811355 0.4177027 3.2262124 ] [ 2.3477416 1.8833163 5.0382493 ] [ 3.2366534 4.7568764 3.4216556 ] [ 1.0960886 3.7401388 4.0439597 ] [ 4.10121 1.4491454 1.6240391 ] [ 3.7203517 3.7771448 1.3362748 ] [ 4.3619753 3.2781325 5.0185287 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6811355e-10 4.177027e-11 3.2262124e-10 ] [ 2.3477416e-10 1.8833163e-10 5.038249300000001e-10 ] [ 3.2366534e-10 4.756876400000001e-10 3.4216556e-10 ] [ 1.0960886e-10 3.7401388e-10 4.043959700000001e-10 ] [ 4.10121e-10 1.4491454e-10 1.6240391e-10 ] [ 3.7203517e-10 3.7771448e-10 1.3362748e-10 ] [ 4.3619753e-10 3.2781325e-10 5.0185287e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.2e-06 6e-07 3.7e-06 ] [ 4.3e-06 2.7e-06 -6.4e-06 ] [ 6e-07 3.6e-06 2.1e-06 ] [ -3.1e-06 -3.4e-06 -7.4e-06 ] [ -7e-06 4.3e-06 9.7e-06 ] [ -1e-07 -3e-07 5.7e-06 ] [ 3.1e-06 -7.5e-06 -7.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.52478856576e-15 9.6130597248e-16 5.928053496960001e-15 ] [ 6.889359469440001e-15 4.32587687616e-15 -1.025393037312e-14 ] [ 9.6130597248e-16 5.76783583488e-15 3.36457090368e-15 ] [ -4.96674752448e-15 -5.44740051072e-15 -1.185610699392e-14 ] [ -1.12152363456e-14 6.889359469440001e-15 1.554111322176e-14 ] [ -1.6021766208e-16 -4.8065298624e-16 9.13240673856e-15 ] [ 4.96674752448e-15 -1.2016324656e-14 -1.185610699392e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.090724 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.738235842534546e-18 } }