{ "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" [ [ 2.060429 2.678734 2.453953 ] [ 2.544795 1.257014 4.108114 ] [ 3.849483 1.551428 2.063601 ] [ 4.178567 2.654376 4.014408 ] [ 4.257126 3.923601 2.295059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.060429e-10 2.678734e-10 2.453953e-10 ] [ 2.544795e-10 1.257014e-10 4.108114e-10 ] [ 3.849483e-10 1.551428e-10 2.063601e-10 ] [ 4.178567e-10 2.654376e-10 4.014408000000001e-10 ] [ 4.257126000000001e-10 3.923601e-10 2.295059e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5719567 2.3842898 -0.7051912 ] [ -1.7028506 -2.4384485 0.3742456 ] [ 1.5640779 -1.2009872 -0.6506738 ] [ 2.672277 0.4041605 3.5397526 ] [ -0.9615476 0.8509854 -2.5581332 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.518552294399747e-09 3.820053406244533e-09 -1.129840863142421e-09 ] [ -2.72826744251288e-09 -3.906825209912348e-09 5.996075556973103e-10 ] [ 2.505929065135788e-09 -1.924193629573085e-09 -1.042494358715989e-09 ] [ 4.281459768975617e-09 6.475365094857569e-10 5.671308905860748e-09 ] [ -1.540569097198778e-09 1.363428923755143e-09 -4.098581239699648e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.258316 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.085522390538834e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0217557 2.8019683 2.3719592 ] [ 2.499869 1.2466515 4.0267484 ] [ 3.9186617 1.5313263 2.1678638 ] [ 4.3789407 2.6038621 4.1407399 ] [ 4.0711729 3.8813448 2.2278236 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0217557e-10 2.8019683e-10 2.3719592e-10 ] [ 2.499869e-10 1.2466515e-10 4.0267484e-10 ] [ 3.9186617e-10 1.5313263e-10 2.1678638e-10 ] [ 4.378940700000001e-10 2.6038621e-10 4.1407399e-10 ] [ 4.0711729e-10 3.8813448e-10 2.2278236e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-05 4.97e-05 -5.5e-06 ] [ 1.71e-05 -4.97e-05 -4.2e-05 ] [ -2.19e-05 -3.79e-05 -4.2e-06 ] [ 4.05e-05 5.19e-05 8.39e-05 ] [ 4.4e-06 -1.4e-05 -3.21e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706535999999e-14 7.96281787098e-14 -8.811971486999999e-15 ] [ 2.73972204414e-14 -7.96281787098e-14 -6.729141862799998e-14 ] [ -3.50876682846e-14 -6.072249442859999e-14 -6.729141862799999e-15 ] [ 6.4888153677e-14 8.315296730459999e-14 1.344226195926e-13 ] [ 7.0495771896e-15 -2.243047287599999e-14 -5.14298699514e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.467452 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.279247335191657e-18 } }