{ "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" [ [ 0.4008083 0.5190667 2.588988 ] [ 0.3705603 2.591564 0.7446841 ] [ 2.694344 0.0700188 2.876141 ] [ 2.159519 1.331763 1.766469 ] [ 2.561241 2.816208 0.1583109 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.008083e-11 5.190667e-11 2.588988e-10 ] [ 3.705603e-11 2.591564e-10 7.446841e-11 ] [ 2.694344e-10 7.001880000000001e-12 2.876141e-10 ] [ 2.159519e-10 1.331763e-10 1.766469e-10 ] [ 2.561241e-10 2.816208e-10 1.583109e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.2704638 -3.0454592 3.0047046 ] [ -3.4986384 0.7538218 -0.4966159 ] [ 6.7122086 -18.606932 15.9464392 ] [ 2.8806733 19.1014026 -16.0125146 ] [ 1.1762203 1.7971668 -2.4420133 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.164856712273273e-08 -4.879363529840271e-09 4.814067462530216e-09 ] [ -5.605436649113119e-09 1.207755664209373e-09 -7.956663844975507e-10 ] [ 1.07541436928527e-08 -2.981159143521539e-08 2.554901207124866e-08 ] [ 4.615347413422785e-09 3.060382067020833e-08 -2.565487653233866e-08 ] [ 1.884512665570362e-09 2.87937863063795e-09 -3.912536616942657e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.1011229 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.764193367007496e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9595052 0.3923853 2.8420649 ] [ 0.4323379 2.7780503 0.3840805 ] [ 1.8486893 -1.2177552 2.7410413 ] [ 2.9616617 2.653942 2.7970433 ] [ 1.9842784 2.7219981 -0.629637 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.595051999999999e-11 3.923853e-11 2.8420649e-10 ] [ 4.323379e-11 2.7780503e-10 3.840805e-11 ] [ 1.8486893e-10 -1.2177552e-10 2.7410413e-10 ] [ 2.9616617e-10 2.653942e-10 2.7970433e-10 ] [ 1.9842784e-10 2.7219981e-10 -6.29637e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.8548961 2.6217486 0.0321016 ] [ -0.4562503 0.0164786 0.2980198 ] [ 0.5637666 -1.0180139 -0.0639631 ] [ -1.4186627 -1.6037347 0.0318615 ] [ 0.4562503 -0.0164786 -0.2980198 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.369694544633099e-09 4.200504312535131e-09 5.143243301027329e-11 ] [ -7.309935638929863e-10 2.640162766351488e-11 4.774803560954919e-10 ] [ 9.032536661079053e-10 -1.631038070229429e-09 -1.024801834138925e-10 ] [ -2.272948210741004e-09 -2.569466242305702e-09 5.104775040361921e-11 ] [ 7.309935638929863e-10 -2.640162766351488e-11 -4.774803560954919e-10 ] ] } "relaxed-potential-energy" { "source-value" -21.714576 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.479058599778478e-18 } }