{ "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" [ [ 0.4656555 2.854978 2.130075 ] [ 2.415045 0.7163998 1.216409 ] [ 1.531563 1.029003 2.475027 ] [ 2.019704 2.428405 0.6522284 ] [ 2.764103 2.749341 2.416687 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.656555e-11 2.854978e-10 2.130075e-10 ] [ 2.415045e-10 7.163998000000001e-11 1.216409e-10 ] [ 1.531563e-10 1.029003e-10 2.475027e-10 ] [ 2.019704e-10 2.428405e-10 6.522284e-11 ] [ 2.764103e-10 2.749341e-10 2.416687e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.2790844 5.0257149 1.8658053 ] [ 6.2246263 -9.8073567 -6.8298813 ] [ -5.469117 -6.1778275 9.3740241 ] [ 0.2844622 4.9675714 -10.127503 ] [ 7.2391128 5.9918978 5.717555 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.326455546731e-08 8.05208291558621e-09 2.98934963062473e-09 ] [ 9.972950731076807e-09 -1.571311761658624e-08 -1.094267614169911e-08 ] [ -8.762491393819835e-09 -9.897970787835312e-09 1.501884225583576e-08 ] [ 4.557586863413338e-10 7.958926759234725e-09 -1.622604853368186e-08 ] [ 1.159833728349403e-08 9.600078569382955e-09 9.160532949138145e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 43.558007 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.978762046404276e-18 } "relaxed-configuration-positions" { "source-value" [ [ -2.5574743 4.9109889 2.7460363 ] [ 4.4308081 -2.3118162 -0.4833713 ] [ 0.1743226 -1.361252 5.4328147 ] [ 2.1615079 4.2656234 -2.8519284 ] [ 4.9869061 4.2745826 4.046875 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.5574743e-10 4.910988900000001e-10 2.7460363e-10 ] [ 4.4308081e-10 -2.3118162e-10 -4.833713e-11 ] [ 1.743226e-11 -1.361252e-10 5.4328147e-10 ] [ 2.1615079e-10 4.2656234e-10 -2.8519284e-10 ] [ 4.9869061e-10 4.2745826e-10 4.046875e-10 ] ] } "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 ] ] "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 ] ] } "relaxed-potential-energy" { "source-value" 1.3322676e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.134528001369326e-34 } }