{ "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" [ [ 0.5178768 0.1602588 0.5935764 ] [ 0.4933098 1.000634 2.761993 ] [ 1.438085 2.624316 0.8145388 ] [ 2.471365 1.192312 0.8679319 ] [ 2.522268 2.85035 2.866422 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.178768e-11 1.602588e-11 5.935764e-11 ] [ 4.933098e-11 1.000634e-10 2.761993e-10 ] [ 1.438085e-10 2.624316e-10 8.145388e-11 ] [ 2.471365e-10 1.192312e-10 8.679319e-11 ] [ 2.522268e-10 2.85035e-10 2.866422e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.2147345 -5.9617747 -2.4607522 ] [ -4.9882826 -2.2369765 7.1350383 ] [ -5.0865427 14.6367802 -4.5968642 ] [ 12.4387945 -9.2558756 -4.696943 ] [ 1.8507654 2.8178466 4.6195211 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.752749078779177e-09 -9.551816042816934e-09 -3.942559644422166e-09 ] [ -7.992109759663437e-09 -3.584031449579011e-09 1.143159155277258e-08 ] [ -8.14953979464091e-09 2.345070704022835e-08 -7.364988350232495e-09 ] [ 1.992914573883563e-08 -1.482954749135317e-08 -7.525332263830215e-09 ] [ 2.965253054465561e-09 4.51468794352077e-09 7.401288705712299e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 0.43948299 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.041293718172802e-20 } "relaxed-configuration-positions" { "source-value" [ [ 0.846082 -0.2613925 1.148454 ] [ 0.46391 0.8907646 3.140473 ] [ 2.5192402 3.1116207 0.8844151 ] [ 2.1159419 1.1113595 -0.2460538 ] [ 1.4977305 2.9755185 2.9771738 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.46082e-11 -2.613925e-11 1.148454e-10 ] [ 4.6391e-11 8.907646e-11 3.140473e-10 ] [ 2.5192402e-10 3.1116207e-10 8.844151e-11 ] [ 2.1159419e-10 1.1113595e-10 -2.460538e-11 ] [ 1.4977305e-10 2.9755185e-10 2.9771738e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.77e-05 -6e-07 1.24e-05 ] [ -5.1e-06 -9.1e-06 -5.8e-06 ] [ -5.5e-06 1.73e-05 -2.49e-05 ] [ 2.08e-05 1.8e-06 6e-06 ] [ 7.6e-06 -9.4e-06 1.24e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.835852618816e-14 -9.6130597248e-16 1.986699009792e-14 ] [ -8.17110076608e-15 -1.457980724928e-14 -9.292624400640001e-15 ] [ -8.8119714144e-15 2.771765553984e-14 -3.989419785791999e-14 ] [ 3.332527371264e-14 2.88391791744e-15 9.6130597248e-15 ] [ 1.217654231808e-14 -1.506046023552e-14 1.986699009792e-14 ] ] } "relaxed-potential-energy" { "source-value" -7.4797183 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.198382979042992e-18 } }