{ "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" [ [ 2.743488 1.903222 1.191758 ] [ 2.092285 1.109675 3.649357 ] [ 1.94045 3.241003 2.726585 ] [ 4.050079 0.1031898 2.277213 ] [ 5.000478 2.032764 2.106801 ] [ 4.158728 1.007331 4.48257 ] [ 3.981083 3.39009 3.613579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743488e-10 1.903222e-10 1.191758e-10 ] [ 2.092285e-10 1.109675e-10 3.649357e-10 ] [ 1.94045e-10 3.241003e-10 2.726585e-10 ] [ 4.050079e-10 1.031898e-11 2.277213e-10 ] [ 5.000478000000001e-10 2.032764e-10 2.106801e-10 ] [ 4.158728e-10 1.007331e-10 4.48257e-10 ] [ 3.981083e-10 3.39009e-10 3.613579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.1249625 -6.7888988 -26.4334914 ] [ -27.2988466 -15.0617389 -17.8470704 ] [ -14.2128658 12.2090868 8.6153997 ] [ -27.2413656 -32.4408587 3.2665313 ] [ 28.257743 29.8403754 -12.6839423 ] [ 33.0585967 7.4024449 31.6024191 ] [ 10.5617008 4.8395893 13.4801541 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.006741899626224e-09 -1.087701502795064e-08 -4.235112227611995e-08 ] [ -4.373757415767035e-08 -2.413156613298886e-08 -2.859415918023303e-08 ] [ -2.277152148693771e-08 1.956111359343783e-08 1.380339209191061e-08 ] [ -4.364547944257139e-08 -5.197598579603561e-08 5.233560123089644e-09 ] [ 4.527389556417706e-08 4.78095522156684e-08 -2.032191598006421e-08 ] [ 5.29657111855695e-08 1.186002425325246e-08 5.06326574598953e-08 ] [ 1.692171023705911e-08 7.753876894616416e-09 2.15975879217393e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 9.0186685 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.444949994049183e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7708063 1.975441 0.6182054 ] [ 1.6021945 0.7449838 3.8657513 ] [ 1.7972268 3.250137 2.8179697 ] [ 3.9062187 -0.1362026 2.2938376 ] [ 5.3927348 2.3090701 1.6881063 ] [ 4.2241223 1.0786265 4.9356506 ] [ 4.2732877 3.565219 3.828342 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7708063e-10 1.975441e-10 6.182054e-11 ] [ 1.6021945e-10 7.449838e-11 3.8657513e-10 ] [ 1.7972268e-10 3.250137e-10 2.8179697e-10 ] [ 3.9062187e-10 -1.362026e-11 2.2938376e-10 ] [ 5.3927348e-10 2.3090701e-10 1.6881063e-10 ] [ 4.224122300000001e-10 1.0786265e-10 4.9356506e-10 ] [ 4.2732877e-10 3.565219e-10 3.828342e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.08e-05 -5.7e-06 -4.7e-06 ] [ 2.4e-06 1.26e-05 -1.4e-05 ] [ -2.32e-05 1.21e-05 4.8e-06 ] [ 2.38e-05 -2.28e-05 1.84e-05 ] [ -8.1e-06 -9.9e-06 9.2e-06 ] [ -1.1e-06 -3.3e-06 -3.75e-05 ] [ 1.7e-05 1.7e-05 2.37e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.73035076472e-14 -9.1324068138e-15 -7.530230179799999e-15 ] [ 3.845223921599999e-15 2.01874255884e-14 -2.243047287599999e-14 ] [ -3.71704979088e-14 1.93863372714e-14 7.690447843199998e-15 ] [ 3.81318038892e-14 -3.65296272552e-14 2.94800500656e-14 ] [ -1.29776307354e-14 -1.58615486766e-14 1.47400250328e-14 ] [ -1.7623942974e-15 -5.2871828922e-15 -6.008162377499999e-14 ] [ 2.723700277799999e-14 2.723700277799999e-14 3.79715862258e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.619169 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.143337415029714e-18 } }