{ "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" [ [ 0.4314663 0.9036294 0.7794334 ] [ 1.004832 0.4139501 2.5602 ] [ 0.3021018 2.478458 1.913452 ] [ 2.709186 0.4632097 1.441964 ] [ 2.312911 2.26354 0.6044428 ] [ 2.800336 2.901369 2.552849 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.314663000000001e-11 9.036294e-11 7.794334000000001e-11 ] [ 1.004832e-10 4.139501e-11 2.5602e-10 ] [ 3.021018e-11 2.478458e-10 1.913452e-10 ] [ 2.709186e-10 4.632097e-11 1.441964e-10 ] [ 2.312911e-10 2.26354e-10 6.044428e-11 ] [ 2.800336e-10 2.901369e-10 2.552849e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.3835693 -9.2676142 -17.2078072 ] [ -5.5777292 -13.5119853 18.3260865 ] [ -14.415198 15.8074092 6.3332325 ] [ 16.7626115 -14.7679657 -1.7861501 ] [ 7.9312927 10.8605196 -17.2538627 ] [ 9.6825922 10.8796364 11.588501 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.304501845611662e-08 -1.48483548018341e-08 -2.756994639107391e-08 ] [ -8.936507321393489e-09 -2.164858694825327e-08 2.93616273410585e-08 ] [ -2.309569321980292e-08 2.532626145565883e-08 1.014695704559074e-08 ] [ 2.685666424885322e-08 -2.366088938131631e-08 -2.861727931459582e-09 ] [ 1.270733173666171e-08 1.740047059286017e-08 -2.764373543643316e-08 ] [ 1.551322285158044e-08 1.743109908288468e-08 1.856682537231742e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 82.930496 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.328693018425479e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.9198331 -0.2563617 -0.8805837 ] [ 0.2621174 -0.7409178 4.5539934 ] [ -1.2893112 4.1156428 2.441668 ] [ 4.5314936 -1.0829697 1.1035693 ] [ 3.0040822 3.5855295 -1.3982839 ] [ 3.9722843 3.8032332 4.031978 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.198331e-11 -2.563617e-11 -8.805837000000001e-11 ] [ 2.621174e-11 -7.409177999999999e-11 4.553993400000001e-10 ] [ -1.2893112e-10 4.1156428e-10 2.441668e-10 ] [ 4.5314936e-10 -1.0829697e-10 1.1035693e-10 ] [ 3.0040822e-10 3.5855295e-10 -1.3982839e-10 ] [ 3.9722843e-10 3.8032332e-10 4.031978e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ -0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 -0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }