{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.2895734e-10 6.4240718e-10 2.6570633e-10 ] [ 1.6071488e-10 2.401157e-10 1.1180263e-10 ] [ 1.8182578e-10 4.3366692e-10 2.1436729e-10 ] ] "source-value" [ [ 2.2895734 6.4240718 2.6570633 ] [ 1.6071488 2.401157 1.1180263 ] [ 1.8182578 4.3366692 2.1436729 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.945058439417408e-11 -5.696827367046145e-11 2.01585862429056e-12 ] [ -3.60505761446208e-12 3.20851890081408e-11 3.428706033810624e-11 ] [ 2.305564200863616e-11 2.488308466232064e-11 -3.63029189623968e-11 ] ] "source-value" [ [ -0.0121401 -0.0355568 0.0012582 ] [ -0.0022501 0.020026 0.0214003 ] [ 0.0143902 0.0155308 -0.0226585 ] ] } "species" { "source-value" [ "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" -9.05342872377896e-19 "source-value" -5.6507058 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.067280022450871e-08 -1.721361706489469e-08 1.227614899772449e-08 ] [ -1.253513187628773e-09 1.635728762722145e-09 4.350477497084073e-09 ] [ 1.192631341213748e-08 1.557788830217254e-08 -1.662662649480856e-08 ] ] "source-value" [ [ -6.661438 -10.7438948 7.6621696 ] [ -0.7823814 1.0209416 2.7153545 ] [ 7.4438194 9.7229532 -10.3775241 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.896804384218756e-19 "source-value" -1.8080431 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.389661e-10 5.795622e-10 1.913778e-10 ] [ 1.983266e-10 3.261141e-10 8.868976e-11 ] [ 1.342053e-10 4.105135e-10 3.118087e-10 ] ] "source-value" [ [ 2.389661 5.795622 1.913778 ] [ 1.983266 3.261141 0.8868976 ] [ 1.342053 4.105135 3.118087 ] ] } "instance-id" 1 }