{ "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" [ [ -0.6974784 0.3459232 0.368356 ] [ 0.3827892 -0.6490604 -0.4416112 ] [ -0.4058924 0.006539 -0.3718783 ] [ 0.2750442 0.4814162 -0.0489653 ] [ 0.4455374 -0.184818 0.4940989 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.117483595199706e-09 5.542300681985086e-10 5.901713761937039e-10 ] [ 6.132959119875528e-10 -1.039909406934693e-09 -7.075391459527008e-10 ] [ -6.503113191981815e-10 1.0476633009726e-11 -5.958147229516421e-10 ] [ 4.406693905572228e-10 7.713137868690707e-10 -7.84510595368002e-11 ] [ 7.138296118531115e-10 -2.96111081142612e-10 7.916337124651025e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.689101 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.033018112866603e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3356591 2.7295354 1.3012526 ] [ 2.3659487 4.0382518 3.3129537 ] [ 4.009416 5.4930523 2.3417854 ] [ 3.9791267 4.1843358 0.3300843 ] [ 4.4021545 3.1341927 2.4386602 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3356591e-10 2.7295354e-10 1.3012526e-10 ] [ 2.3659487e-10 4.0382518e-10 3.3129537e-10 ] [ 4.009416e-10 5.493052300000001e-10 2.3417854e-10 ] [ 3.9791267e-10 4.1843358e-10 3.300843e-11 ] [ 4.4021545e-10 3.1341927e-10 2.4386602e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.3e-06 -2.3e-06 -1.6e-06 ] [ -4.2e-06 5e-07 4e-06 ] [ 1e-06 4.8e-06 5e-07 ] [ 1.2e-06 1.6e-06 -6.1e-06 ] [ 5.3e-06 -4.6e-06 3.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.2871828922e-15 -3.685006258199999e-15 -2.5634826144e-15 ] [ -6.729141862799999e-15 8.010883169999999e-16 6.408706535999999e-15 ] [ 1.602176634e-15 7.690447843199998e-15 8.010883169999999e-16 ] [ 1.9226119608e-15 2.5634826144e-15 -9.773277467399999e-15 ] [ 8.4915361602e-15 -7.370012516399999e-15 4.9667475654e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.13731965152234e-18 } }