{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.384535 1.809355 2.901981 ] [ 1.948299 3.967012 2.633856 ] [ 1.645033 3.274995 4.707865 ] [ 4.440095 1.758867 2.666287 ] [ 3.649735 2.240012 5.07701 ] [ 4.164388 4.024114 1.736165 ] [ 3.303688 4.596831 4.046686 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.384535e-10 1.809355e-10 2.901981e-10 ] [ 1.948299e-10 3.967012e-10 2.633856000000001e-10 ] [ 1.645033e-10 3.274995e-10 4.707865e-10 ] [ 4.440095e-10 1.758867e-10 2.666287e-10 ] [ 3.649735e-10 2.240012e-10 5.07701e-10 ] [ 4.164388e-10 4.024114e-10 1.736165e-10 ] [ 3.303688e-10 4.596831e-10 4.046686e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.1026185 -3.1792259 -1.3210609 ] [ -2.9229257 1.8450869 -2.6184553 ] [ -3.2040627 0.049744 2.7995915 ] [ 2.8770055 -2.0834833 -1.0485026 ] [ 1.6916174 -1.4921398 2.9573623 ] [ 1.8999043 1.4436339 -2.5001057 ] [ 1.7610797 3.4163842 1.7311707 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.368766203161565e-09 -5.093681409221839e-09 -2.116572888633007e-09 ] [ -4.683043220875475e-09 2.956155094524348e-09 -4.19522786426985e-09 ] [ -5.133474349517325e-09 7.969867382507519e-11 4.485440049090403e-09 ] [ 4.609470950013015e-09 -3.338108233087233e-09 -1.679886352568014e-09 ] [ 2.710269849618481e-09 -2.390671502525188e-09 4.738216736295316e-09 ] [ 3.043982251217389e-09 2.312956483574325e-09 -4.005610902068819e-09 ] [ 2.821560722705478e-09 5.473650892910512e-09 2.773641222153971e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 17.972872 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.879571532703094e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0373976 -0.0842215 2.2454723 ] [ 0.0966129 5.2415646 1.1944495 ] [ -0.3709881 3.4033509 6.3570379 ] [ 6.5298269 0.1963998 1.9767962 ] [ 4.6672192 1.3031605 7.0320679 ] [ 5.4370617 5.162914 -0.1183411 ] [ 4.1386428 6.4480178 5.0823674 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0373976e-10 -8.42215e-12 2.2454723e-10 ] [ 9.66129e-12 5.2415646e-10 1.1944495e-10 ] [ -3.709881e-11 3.4033509e-10 6.3570379e-10 ] [ 6.5298269e-10 1.963998e-11 1.9767962e-10 ] [ 4.6672192e-10 1.3031605e-10 7.032067900000001e-10 ] [ 5.437061700000001e-10 5.162914e-10 -1.183411e-11 ] [ 4.1386428e-10 6.4480178e-10 5.0823674e-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 ] [ 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 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 1.3322676e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.134528001369326e-34 } }