{ "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" [ [ 2.376748 2.356906 1.723048 ] [ 1.891208 1.427855 3.861744 ] [ 2.621896 4.609245 2.418974 ] [ 4.560356 2.199202 1.122098 ] [ 4.097908 2.987714 3.135416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.376748e-10 2.356906e-10 1.723048e-10 ] [ 1.891208e-10 1.427855e-10 3.861744e-10 ] [ 2.621896e-10 4.609245e-10 2.418974e-10 ] [ 4.560356e-10 2.199202e-10 1.122098e-10 ] [ 4.097908e-10 2.987714e-10 3.135416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.6625475 -2.1457935 -2.3839416 ] [ 0.3122993 -0.0148339 0.0371828 ] [ -1.2967365 3.1255649 0.0595026 ] [ 3.386167 -1.7310291 -3.4538561 ] [ 3.2608177 0.7660915 5.7411124 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.072401218669487e-09 -3.437940178764605e-09 -3.819495496872545e-09 ] [ 5.003586371522054e-10 -2.376652777528512e-11 5.957341285588224e-11 ] [ -2.077600903638019e-09 5.00770700957309e-09 9.533367459681409e-11 ] [ 5.425237601524474e-09 -2.773414353944466e-09 -5.533687495027466e-09 ] [ 5.224405883630828e-09 1.227413890693603e-09 9.198276064664978e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.8251401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.574160976430458e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9867964 1.9693294 1.2776989 ] [ 2.0649728 2.049627 3.7416421 ] [ 2.6905346 4.2406776 2.4158893 ] [ 4.3638116 2.6205373 1.1810452 ] [ 4.4420006 2.7007507 3.6450044 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9867964e-10 1.9693294e-10 1.2776989e-10 ] [ 2.0649728e-10 2.049627e-10 3.7416421e-10 ] [ 2.6905346e-10 4.2406776e-10 2.4158893e-10 ] [ 4.3638116e-10 2.6205373e-10 1.1810452e-10 ] [ 4.4420006e-10 2.7007507e-10 3.6450044e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.6e-06 1.56e-05 -9.4e-06 ] [ -1.92e-05 -5.7e-06 5.3e-06 ] [ -3e-06 -1.61e-05 5.2e-06 ] [ -4.2e-06 -1.08e-05 3.15e-05 ] [ 2.08e-05 1.69e-05 -3.26e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.972189076479999e-15 2.499395528448e-14 -1.506046023552e-14 ] [ -3.076179111936e-14 -9.13240673856e-15 8.491536090240001e-15 ] [ -4.8065298624e-15 -2.579504359488e-14 8.33131842816e-15 ] [ -6.72914180736e-15 -1.730350750464e-14 5.04685635552e-14 ] [ 3.332527371264e-14 2.707678489152e-14 -5.223095783807999e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.901027 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.906754722290956e-18 } }