{ "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" [ [ 2.841627 2.849258 1.50686 ] [ 0.998489 4.149663 3.105849 ] [ 4.765797 1.647113 1.498592 ] [ 3.299037 1.906995 3.475865 ] [ 3.256514 4.175642 3.223298 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.841627e-10 2.849258e-10 1.50686e-10 ] [ 9.98489e-11 4.149663e-10 3.105849e-10 ] [ 4.765797e-10 1.647113e-10 1.498592e-10 ] [ 3.299037e-10 1.906995e-10 3.475865e-10 ] [ 3.256514e-10 4.175642e-10 3.223298000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.9865086 0.8339565 -6.9996538 ] [ -1.356421 0.148614 -0.5021742 ] [ 2.3714422 -1.7187478 -0.6719217 ] [ 1.2313062 -4.4947774 4.6794567 ] [ 1.7401811 5.2309547 3.494293 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.387090930160052e-09 1.336145618072421e-09 -1.121468176444931e-08 ] [ -2.173226032066914e-09 2.38105878285276e-10 -8.045717694376427e-10 ] [ 3.799469281721555e-09 -2.753737564898905e-09 -1.076537247617558e-09 ] [ 1.972770022939331e-09 -7.201427325311271e-09 7.497316184554747e-09 ] [ 2.788077497348417e-09 8.380913393852478e-09 5.598474596949761e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.4636721 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.195812104245771e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2902215 2.8046006 0.7359402 ] [ 1.5493098 4.2422882 2.4036425 ] [ 4.0566492 1.5619477 1.5919206 ] [ 4.4074404 2.2316274 3.7886505 ] [ 2.8578431 3.8882071 4.2903103 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2902215e-10 2.8046006e-10 7.359402000000001e-11 ] [ 1.5493098e-10 4.2422882e-10 2.4036425e-10 ] [ 4.0566492e-10 1.5619477e-10 1.5919206e-10 ] [ 4.4074404e-10 2.2316274e-10 3.7886505e-10 ] [ 2.8578431e-10 3.8882071e-10 4.2903103e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3e-05 -3.95e-05 -1.37e-05 ] [ -4.1e-06 4.18e-05 2.91e-05 ] [ -1.97e-05 0.0 -5.3e-06 ] [ -2.26e-05 5.26e-05 1.5e-06 ] [ 1.65e-05 -5.5e-05 -1.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.806529901999999e-14 -6.328597704299999e-14 -2.19498198858e-14 ] [ -6.568924199399999e-15 6.697098330119999e-14 4.66233400494e-14 ] [ -3.15628796898e-14 0.0 -8.4915361602e-15 ] [ -3.62091919284e-14 8.42744909484e-14 2.403264951e-15 ] [ 2.6435914461e-14 -8.811971486999999e-14 -1.85852489544e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.435516 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.992389316693314e-18 } }