{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.569029 2.409456 2.459016 ] [ 1.280031 0.1374919 2.779238 ] [ 3.588101 1.133333 2.932926 ] [ 4.931515 2.722575 2.426382 ] [ 3.330231 3.38172 3.93095 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.569029e-10 2.409456e-10 2.459016e-10 ] [ 1.280031e-10 1.374919e-11 2.779238e-10 ] [ 3.588101e-10 1.133333e-10 2.932926e-10 ] [ 4.931515000000001e-10 2.722575e-10 2.426382e-10 ] [ 3.330231e-10 3.38172e-10 3.93095e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0116872 1.4318649 -1.0446762 ] [ -1.3643092 -1.9800792 0.0597964 ] [ 1.047104 -2.3738961 0.2174292 ] [ 2.4919496 0.9115007 -1.2710677 ] [ -0.1630573 2.0106098 2.0385184 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.223078200202614e-09 2.29410046692413e-09 -1.673755783946185e-09 ] [ -2.185864303782351e-09 -3.172436601572368e-09 9.580439408800513e-11 ] [ 1.677645548346163e-09 -3.803400831628299e-09 3.483599809192474e-10 ] [ 3.992543389331911e-09 1.460385111382835e-09 -2.036474952394028e-09 ] [ -2.612465939107718e-10 3.221352015111364e-09 3.266066521550623e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 8.5144072 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.364158415581119e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3703043 3.6062193 1.2017035 ] [ -0.49429 -1.5512672 2.9235082 ] [ 4.9041907 -0.7144278 3.5607719 ] [ 6.5409043 3.9371912 1.1248721 ] [ 3.3777977 4.5068603 5.7176562 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.703043e-11 3.6062193e-10 1.2017035e-10 ] [ -4.9429e-11 -1.5512672e-10 2.9235082e-10 ] [ 4.9041907e-10 -7.144278e-11 3.5607719e-10 ] [ 6.5409043e-10 3.9371912e-10 1.1248721e-10 ] [ 3.3777977e-10 4.5068603e-10 5.7176562e-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 ] ] "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 ] ] } "relaxed-potential-energy" { "source-value" 8.8817842e-16 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.423018699623083e-34 } }