{ "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" [ [ 1.839564 1.867321 2.162261 ] [ 1.684665 2.737292 4.133334 ] [ 1.168876 4.298629 2.101191 ] [ 4.284365 2.457862 3.031672 ] [ 3.236614 0.5901118 4.309357 ] [ 3.135041 3.239997 1.121025 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.839564e-10 1.867321e-10 2.162261e-10 ] [ 1.684665e-10 2.737292e-10 4.133334e-10 ] [ 1.168876e-10 4.298629e-10 2.101191e-10 ] [ 4.284365e-10 2.457862e-10 3.031672e-10 ] [ 3.236614e-10 5.901118e-11 4.309357e-10 ] [ 3.135041e-10 3.239997e-10 1.121025e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.3509285 -16.0178992 -10.6246572 ] [ -9.5035469 3.3872091 15.1994418 ] [ -7.0967358 13.3085029 -2.0613183 ] [ 19.5558275 2.0110345 2.6234368 ] [ 3.933922 -7.2718689 5.8427525 ] [ 7.4614617 4.5830216 -10.9796557 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.299272212947241e-08 -2.566350361257102e-08 -1.702257736985439e-08 ] [ -1.522636065785632e-08 5.426907229781009e-09 2.435219030117027e-08 ] [ -1.137022418275438e-08 2.1322572204229e-08 -3.302595988287201e-09 ] [ 3.133188962089771e-08 3.222032459522218e-09 4.203209107106366e-09 ] [ 6.302837856450778e-09 -1.165081834110261e-08 9.361121456620752e-09 ] [ 1.195457949273462e-08 7.34281006014141e-09 -1.759134766697346e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 2.3970068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.840428254858622e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.9452344 0.8944281 1.6407807 ] [ 1.4178981 3.0476839 4.5518145 ] [ 1.5383955 4.4056495 2.5865129 ] [ 4.6577564 2.5247313 2.9336159 ] [ 2.8095508 1.1973783 3.965261 ] [ 2.9802898 3.1213417 1.180855 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9452344e-10 8.944281e-11 1.6407807e-10 ] [ 1.4178981e-10 3.0476839e-10 4.5518145e-10 ] [ 1.5383955e-10 4.4056495e-10 2.5865129e-10 ] [ 4.6577564e-10 2.5247313e-10 2.9336159e-10 ] [ 2.8095508e-10 1.1973783e-10 3.965261e-10 ] [ 2.9802898e-10 3.1213417e-10 1.180855e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.05e-05 2.9e-06 2.14e-05 ] [ -1e-07 -1.94e-05 1.16e-05 ] [ 1.26e-05 4.76e-05 -2.1e-05 ] [ -3.58e-05 -5.1e-06 4e-07 ] [ 1.18e-05 1.89e-05 -6.36e-05 ] [ -1.9e-05 -4.5e-05 5.11e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.88663869344e-14 4.646312200320001e-15 3.428657968511999e-14 ] [ -1.6021766208e-16 -3.108222644352e-14 1.858524880128e-14 ] [ 2.018742542208e-14 7.626360715008e-14 -3.36457090368e-14 ] [ -5.735792302464001e-14 -8.17110076608e-15 6.408706483200001e-16 ] [ 1.890568412544e-14 3.028113813312e-14 -1.0189843308288e-13 ] [ -3.04413557952e-14 -7.209794793600001e-14 8.187122532288001e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.021911 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.246557798313835e-18 } }