{ "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" [ [ 2.561149 2.354583 1.277193 ] [ 2.183709 4.435975 3.101892 ] [ 4.282438 5.412611 2.58259 ] [ 3.622423 4.256941 0.4406492 ] [ 4.442586 3.119258 2.322412 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.561149e-10 2.354583e-10 1.277193e-10 ] [ 2.183709e-10 4.435975e-10 3.101892e-10 ] [ 4.282438e-10 5.412611e-10 2.58259e-10 ] [ 3.622423e-10 4.256941000000001e-10 4.406492e-11 ] [ 4.442586e-10 3.119258e-10 2.322412e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0415689 0.0837391 0.3823866 ] [ 0.4280237 -0.7958789 -0.6824092 ] [ -0.2994345 0.2969525 -0.3980505 ] [ 0.0878039 0.9991363 -0.357712 ] [ 0.8251759 -0.583949 1.055785 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.668777340532373e-09 1.341648282668333e-10 6.126508706272013e-10 ] [ 6.85769565288313e-10 -1.275138566568021e-09 -1.093340066058831e-09 ] [ -4.797469553609376e-10 4.75770352988112e-10 -6.377472049977504e-10 ] [ 1.406773557950611e-10 1.600792820852615e-09 -5.731178033796097e-10 ] [ 1.322077535027599e-09 -9.355894355395392e-10 1.691554043591328e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.619248 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.502479398007716e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3242371 2.7514229 1.2955239 ] [ 2.3591099 4.045417 3.2999539 ] [ 3.9896724 5.4958903 2.3351864 ] [ 3.9548323 4.2018693 0.3307721 ] [ 4.4644533 3.0847684 2.4632999 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3242371e-10 2.7514229e-10 1.2955239e-10 ] [ 2.3591099e-10 4.045417e-10 3.2999539e-10 ] [ 3.9896724e-10 5.4958903e-10 2.3351864e-10 ] [ 3.9548323e-10 4.2018693e-10 3.307721e-11 ] [ 4.4644533e-10 3.0847684e-10 2.4632999e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.6e-06 -1.03e-05 -2.4e-06 ] [ 3e-07 9.3e-06 -5.2e-06 ] [ 5.1e-06 2e-07 5.9e-06 ] [ -9.3e-06 4.3e-06 3e-07 ] [ -1.6e-06 -3.5e-06 1.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.972189076479999e-15 -1.650241919424e-14 -3.84522388992e-15 ] [ 4.8065298624e-16 1.490024257344e-14 -8.33131842816e-15 ] [ 8.17110076608e-15 3.2043532416e-16 9.45284206272e-15 ] [ -1.490024257344e-14 6.889359469440001e-15 4.8065298624e-16 ] [ -2.56348259328e-15 -5.6076181728e-15 2.08282960704e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.28693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609453847060615e-18 } }