{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2482594 0.208506 0.7144033 ] [ 0.1842271 0.5542422 2.415306 ] [ 0.3347056 2.949491 0.3757933 ] [ 2.042519 0.2544893 1.784175 ] [ 2.203059 1.053322 2.694572 ] [ 1.978392 2.822156 1.26577 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.482594e-11 2.08506e-11 7.144033e-11 ] [ 1.842271e-11 5.542422e-11 2.415306e-10 ] [ 3.347056e-11 2.949491e-10 3.757933e-11 ] [ 2.042519e-10 2.544893e-11 1.784175e-10 ] [ 2.203059e-10 1.053322e-10 2.694572e-10 ] [ 1.978392e-10 2.822156e-10 1.26577e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.3220846 0.4396065 -20.6940061 ] [ -12.1427093 6.3039059 18.6978604 ] [ -9.6377447 -3.3205169 -3.4134797 ] [ -3.5387956 -89.5615188 -100.2889599 ] [ 20.691271 88.2970493 101.2341996 ] [ 7.9500631 -2.158526 4.4643857 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.322566278439721e-09 7.043272566517152e-10 -3.315545276411258e-08 ] [ -1.945476495363073e-08 1.009997065270318e-08 2.995727479186213e-08 ] [ -1.544136923557911e-08 -5.320054546151291e-09 -5.468997370915397e-09 ] [ -5.669775576109908e-09 -1.434933715446997e-07 -1.606806268761287e-07 ] [ 3.315107065083703e-08 1.41467468074085e-07 1.621950678245207e-07 ] [ 1.273740523270477e-08 -3.458339892588941e-09 7.152734394773843e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 23.327142 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.737420154248175e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5127832 0.5726502 0.026726 ] [ 0.2135135 1.0746261 2.4051136 ] [ -0.3042635 2.7396418 0.7336073 ] [ 2.1556204 -0.2000675 1.629455 ] [ 2.3939641 1.470508 3.3659605 ] [ 2.0195443 2.184848 1.0891572 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.127832e-11 5.726502e-11 2.6726e-12 ] [ 2.135135e-11 1.0746261e-10 2.4051136e-10 ] [ -3.042635e-11 2.7396418e-10 7.336073e-11 ] [ 2.1556204e-10 -2.000675e-11 1.629455e-10 ] [ 2.3939641e-10 1.470508e-10 3.3659605e-10 ] [ 2.0195443e-10 2.184848e-10 1.0891572e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.99e-05 1.02e-05 -2.01e-05 ] [ -1.78e-05 -5.1e-06 4.14e-05 ] [ -1.9e-05 -5.4e-06 -8.9e-06 ] [ 2.1e-05 -5.61e-05 -1.7e-06 ] [ -1.63e-05 1.12e-05 8e-06 ] [ 5.2e-05 4.51e-05 -1.89e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.188331475392e-14 1.634220153216e-14 -3.220375007808e-14 ] [ -2.851874385024e-14 -8.17110076608e-15 6.633011210111999e-14 ] [ -3.04413557952e-14 -8.65175375232e-15 -1.425937192512e-14 ] [ 3.36457090368e-14 -8.988210842688002e-14 -2.72370025536e-15 ] [ -2.611547891904e-14 1.794437815296e-14 1.28174129664e-14 ] [ 8.33131842816e-14 7.225816559807999e-14 -3.028113813312e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.902638 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.829624777904567e-18 } }