{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.7532128e-10 5.4056222e-10 3.9901083e-10 ] [ 2.0745674e-10 3.2517163e-10 3.3307115e-10 ] [ 3.0601898e-10 2.7131272e-10 5.3979644e-10 ] [ 4.327076e-10 3.154466e-10 2.6567602e-10 ] [ 4.6840321e-10 4.265296400000001e-10 4.7001526e-10 ] ] "source-value" [ [ 2.7532128 5.4056222 3.9901083 ] [ 2.0745674 3.2517163 3.3307115 ] [ 3.0601898 2.7131272 5.3979644 ] [ 4.327076 3.154466 2.6567602 ] [ 4.6840321 4.2652964 4.7001526 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.11951945165632e-12 -9.5233378340352e-13 -1.16125761475584e-12 ] [ 2.77769360748096e-12 2.739722021568e-13 -1.6878930700128e-12 ] [ -4.155725719031039e-12 -2.34350374324416e-12 3.96843127205952e-12 ] [ -2.4705563492736e-12 2.70976131875904e-12 9.888634103577602e-13 ] [ 5.96794769481792e-12 3.1210400573184e-13 -2.10830421531072e-12 ] ] "source-value" [ [ -0.0013229 -0.0005944 -0.0007248 ] [ 0.0017337 0.000171 -0.0010535 ] [ -0.0025938 -0.0014627 0.0024769 ] [ -0.001542 0.0016913 0.0006172 ] [ 0.0037249 0.0001948 -0.0013159 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.397630096193368e-18 "source-value" -8.723321 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.630684790284543e-09 1.190119544838255e-09 3.112644651825408e-11 ] [ -5.589304653153608e-09 1.309323568255383e-09 -4.05719570207573e-09 ] [ -1.621339774708403e-09 -3.482434706353828e-09 7.070166382838577e-09 ] [ 3.705455769357243e-09 -4.025779101371449e-09 -5.042022588655047e-09 ] [ 5.13587344878931e-09 5.008770694631638e-09 1.997925461373945e-09 ] ] "source-value" [ [ -1.0177934 0.7428142 0.0194276 ] [ -3.4885696 0.8172155 -2.5323024 ] [ -1.0119607 -2.1735648 4.4128508 ] [ 2.3127636 -2.5126937 -3.146983 ] [ 3.2055601 3.1262288 1.247007 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.018999631615529e-18 "source-value" -6.3600955 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.487281e-10 5.921696e-10 4.58109e-10 ] [ 2.384555e-10 3.657598e-10 3.132891e-10 ] [ 3.419185e-10 2.494172e-10 4.950414999999999e-10 ] [ 4.429689e-10 2.154563e-10 3.12196e-10 ] [ 4.178368e-10 4.562199e-10 4.289341000000001e-10 ] ] "source-value" [ [ 2.487281 5.921696 4.58109 ] [ 2.384555 3.657598 3.132891 ] [ 3.419185 2.494172 4.950415 ] [ 4.429689 2.154563 3.12196 ] [ 4.178368 4.562199 4.289341 ] ] } "instance-id" 1 }