{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8888047 2.050538 1.655197 ] [ 2.913325 1.361036 3.047712 ] [ 2.022581 2.448681 4.72594 ] [ 1.815806 3.470528 2.839754 ] [ 4.233041 2.418243 4.364549 ] [ 4.034854 4.068796 2.809397 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.888047000000001e-11 2.050538e-10 1.655197e-10 ] [ 2.913325e-10 1.361036e-10 3.047712e-10 ] [ 2.022581e-10 2.448681e-10 4.72594e-10 ] [ 1.815806e-10 3.470528e-10 2.839754e-10 ] [ 4.233041e-10 2.418243e-10 4.364549e-10 ] [ 4.034854000000001e-10 4.068796e-10 2.809397e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.346257 -2.6404613 -5.4799438 ] [ 1.7711557 -8.2915361 -3.067335 ] [ -4.6972018 -0.4989898 8.362062 ] [ -4.2118102 6.5968606 -1.9199345 ] [ 7.4924921 -1.0811431 5.0482925 ] [ 4.9916211 5.9152697 -2.9431411 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.565647974188344e-09 -4.230485362987175e-09 -8.779837839657912e-09 ] [ 2.837704254336658e-09 -1.328450528993921e-08 -4.914412425161568e-09 ] [ -7.525746907139678e-09 -7.994697915776679e-10 1.339750023808009e-08 ] [ -6.748063833686973e-09 1.056933582399666e-08 -3.076074169367338e-09 ] [ 1.20042956741487e-08 -1.732182198559236e-09 8.088256218459985e-09 ] [ 7.997458626311978e-09 9.477306819066629e-09 -4.715431862135596e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 44.840983 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.184317461629025e-18 } "relaxed-configuration-positions" { "source-value" [ [ -1.8665787 0.8582518 -0.9700317 ] [ 4.1813628 -2.0452324 2.0324142 ] [ 0.0817993 1.7218096 7.6929368 ] [ -0.4746653 7.0780495 2.6905831 ] [ 7.4128897 2.1793206 7.1051732 ] [ 6.5736041 6.0256229 0.8914733 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.8665787e-10 8.582518e-11 -9.700317000000001e-11 ] [ 4.1813628e-10 -2.0452324e-10 2.0324142e-10 ] [ 8.179930000000001e-12 1.7218096e-10 7.6929368e-10 ] [ -4.746653000000001e-11 7.0780495e-10 2.6905831e-10 ] [ 7.4128897e-10 2.1793206e-10 7.105173200000001e-10 ] [ 6.5736041e-10 6.0256229e-10 8.914733000000001e-11 ] ] } "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 ] ] "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 ] ] } "relaxed-potential-energy" { "source-value" 1.3322676e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.134528001369326e-34 } }