{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.463646 2.399639 1.70499 ] [ 1.562869 2.634357 3.942252 ] [ 0.7671946 4.252199 0.5443388 ] [ 2.243771 4.169464 2.448835 ] [ 3.362616 2.323379 2.490002 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.463646e-10 2.399639e-10 1.70499e-10 ] [ 1.562869e-10 2.634357e-10 3.942252e-10 ] [ 7.671945999999999e-11 4.252199e-10 5.443388e-11 ] [ 2.243771e-10 4.169464e-10 2.448835e-10 ] [ 3.362616e-10 2.323379e-10 2.490002e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.4983888 -10.1688543 -10.1807332 ] [ -3.5331093 -2.1302292 9.2661345 ] [ -1.2439279 1.7992686 -1.9036644 ] [ 2.3110347 16.6089989 1.2302676 ] [ 13.9643913 -6.109184 1.5879954 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.842244971222857e-08 -1.629230061978155e-08 -1.631133271564237e-08 ] [ -5.660665119191054e-09 -3.413003421185488e-09 1.48459840610883e-08 ] [ -1.99299219934084e-09 2.882746085459547e-09 -3.05000659552926e-09 ] [ 3.702685766197542e-09 2.661054973247292e-08 1.971105986047726e-09 ] [ 2.237342126456292e-08 -9.787991776965427e-09 2.544249103817945e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.0972998 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.962421327168516e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.165665 2.0046991 1.5168278 ] [ 1.4742813 2.6485395 3.9856552 ] [ 0.8804325 4.2263523 0.6566751 ] [ 2.3363272 4.5832967 2.5301533 ] [ 3.5433906 2.3161505 2.4411064 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.165665e-10 2.0046991e-10 1.5168278e-10 ] [ 1.4742813e-10 2.6485395e-10 3.9856552e-10 ] [ 8.804325e-11 4.226352300000001e-10 6.566751e-11 ] [ 2.3363272e-10 4.5832967e-10 2.5301533e-10 ] [ 3.5433906e-10 2.3161505e-10 2.4411064e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.22e-05 5.7e-06 7.7e-06 ] [ 1.71e-05 4.7e-06 -1.37e-05 ] [ 1.52e-05 -8.3e-06 -7e-06 ] [ -9.5e-06 -1.51e-05 1.58e-05 ] [ -1.06e-05 1.29e-05 -2.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.954655477376e-14 9.13240673856e-15 1.233675998016e-14 ] [ 2.739722021568e-14 7.53023011776e-15 -2.194981970496e-14 ] [ 2.435308463616e-14 -1.329806595264e-14 -1.12152363456e-14 ] [ -1.52206778976e-14 -2.419286697408e-14 2.531439060864e-14 ] [ -1.698307218048e-14 2.066807840832e-14 -4.48609453824e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.750145 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.722363098921002e-18 } }