{ "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" [ [ 1.08267 0.385996 1.67532 ] [ 0.7413004 2.189146 0.0242846 ] [ 0.0452684 1.636125 2.5153 ] [ 2.351375 1.598321 0.2166547 ] [ 2.147702 1.718144 2.949578 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.08267e-10 3.85996e-11 1.67532e-10 ] [ 7.413004e-11 2.189146e-10 2.42846e-12 ] [ 4.52684e-12 1.636125e-10 2.5153e-10 ] [ 2.351375e-10 1.598321e-10 2.166547e-11 ] [ 2.147702e-10 1.718144e-10 2.949578e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.995633 -15.9846462 -6.4965785 ] [ -17.9921579 7.7256491 -2.6424542 ] [ -11.7600435 9.6574713 5.1060415 ] [ 19.2148005 -4.8585116 1.1544102 ] [ 6.5417679 3.4600374 2.8785809 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.401709777896967e-09 -2.561022643339956e-08 -1.040866618789193e-08 ] [ -2.882661474512202e-08 1.237785436852456e-08 -4.233678340774767e-09 ] [ -1.8841666755291e-08 1.547297473290698e-08 8.180780316134563e-09 ] [ 3.078550413443615e-08 -7.784193697405602e-09 1.849569033253052e-09 ] [ 1.048106758807991e-08 5.543591029373618e-09 4.611995019061423e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.1588377 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.265369153441645e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0693665 0.0173101 1.4254023 ] [ 0.6208068 2.3892229 0.4505328 ] [ -0.3251974 1.6849844 2.6484969 ] [ 2.8725145 1.3260893 0.3039481 ] [ 2.1308254 2.1101253 2.5527572 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0693665e-10 1.73101e-12 1.4254023e-10 ] [ 6.208068e-11 2.3892229e-10 4.505328e-11 ] [ -3.251974000000001e-11 1.6849844e-10 2.6484969e-10 ] [ 2.8725145e-10 1.3260893e-10 3.039481e-11 ] [ 2.1308254e-10 2.1101253e-10 2.5527572e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.5e-06 1.01e-05 -1.18e-05 ] [ -4.04e-05 -1.8e-05 -6.29e-05 ] [ 1.54e-05 1.73e-05 2.32e-05 ] [ 1.42e-05 2.01e-05 1.84e-05 ] [ 1.94e-05 -2.95e-05 3.31e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.36185012768e-14 1.618198387008e-14 -1.890568412544e-14 ] [ -6.472793548032e-14 -2.88391791744e-14 -1.0077690944832e-13 ] [ 2.467351996032e-14 2.771765553984e-14 3.717049760256e-14 ] [ 2.275090801536e-14 3.220375007808e-14 2.948004982272e-14 ] [ 3.108222644352e-14 -4.72642103136e-14 5.303204614848e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.840953 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.538000454779163e-18 } }