{ "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" [ [ 2.06977 2.12479 1.528563 ] [ 2.041317 1.533814 3.912889 ] [ 1.700439 5.299543 2.410292 ] [ 0.6511626 3.199571 3.041419 ] [ 2.983959 3.688065 3.444542 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.06977e-10 2.12479e-10 1.528563e-10 ] [ 2.041317e-10 1.533814e-10 3.912889e-10 ] [ 1.700439e-10 5.299543e-10 2.410292e-10 ] [ 6.511626e-11 3.199571e-10 3.041419e-10 ] [ 2.983959e-10 3.688065e-10 3.444542e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5253813 0.5626269 1.4169035 ] [ 0.2035433 0.2952025 -0.723758 ] [ -0.3495974 -0.836757 0.108815 ] [ -0.5951658 0.7775257 -0.1898771 ] [ 0.2158386 -0.7985981 -0.6120834 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.417536358655112e-10 9.014276654131796e-10 2.270129661629693e-09 ] [ 3.261123165804807e-10 4.72966543901712e-10 -1.159588146716966e-09 ] [ -5.601167809724659e-10 -1.340632502690746e-09 1.74340848992352e-10 ] [ -9.535607302597286e-10 1.245733498611155e-09 -3.042166504453037e-10 ] [ 3.458115587862029e-10 -1.2794952052353e-09 -9.806657134597747e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -19.657566 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.149489266703297e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1273775 2.5525641 1.587707 ] [ 2.0290405 1.5057648 3.6949092 ] [ 1.7496183 4.8325491 2.0401743 ] [ 0.5435735 3.3027823 3.363438 ] [ 2.9970379 3.6521226 3.6514765 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1273775e-10 2.5525641e-10 1.587707e-10 ] [ 2.0290405e-10 1.5057648e-10 3.6949092e-10 ] [ 1.7496183e-10 4.8325491e-10 2.0401743e-10 ] [ 5.435735000000001e-11 3.3027823e-10 3.363438e-10 ] [ 2.9970379e-10 3.6521226e-10 3.6514765e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-07 1.2e-06 1.2e-06 ] [ 5e-07 -2.4e-06 -1e-06 ] [ 3e-07 -0.0 -2.6e-06 ] [ 3.4e-06 1.2e-06 1.6e-06 ] [ -3.9e-06 1e-07 7e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706483200001e-16 1.92261194496e-15 1.92261194496e-15 ] [ 8.010883104e-16 -3.84522388992e-15 -1.6021766208e-15 ] [ 4.8065298624e-16 0.0 -4.16565921408e-15 ] [ 5.44740051072e-15 1.92261194496e-15 2.56348259328e-15 ] [ -6.24848882112e-15 1.6021766208e-16 1.12152363456e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.115797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.383123628295878e-18 } }