{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.61188 5.080623 2.93239 ] [ 4.855786 1.762639 3.084137 ] [ 3.780411 3.32193 1.747479 ] [ 4.346291 4.090656 3.759617 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.61188e-10 5.080623e-10 2.93239e-10 ] [ 4.855786000000001e-10 1.762639e-10 3.084137e-10 ] [ 3.780411e-10 3.32193e-10 1.747479e-10 ] [ 4.346291e-10 4.090656e-10 3.759617e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.0339953 2.7704744 -1.3277403 ] [ 0.9579777 -1.5327535 0.9056475 ] [ -1.5709294 -1.0072368 -5.4544982 ] [ 4.646947 -0.2304841 5.8765909 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.463172958077082e-09 4.438789312204908e-09 -2.127274467153978e-09 ] [ 1.534849474187756e-09 -2.455741823149373e-09 1.451007251185968e-09 ] [ -2.516906357607372e-09 -1.613771252569406e-09 -8.739069494235683e-09 ] [ 7.445229841496697e-09 -3.692762364861293e-10 9.41533654998603e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.0759134 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.73468639948544e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.9368865 4.9412372 2.777006 ] [ 4.8602972 2.186687 2.9848051 ] [ 3.3725308 3.0816472 1.3567039 ] [ 4.4246535 4.0462766 4.4051079 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9368865e-10 4.9412372e-10 2.777006e-10 ] [ 4.8602972e-10 2.186687e-10 2.9848051e-10 ] [ 3.3725308e-10 3.0816472e-10 1.3567039e-10 ] [ 4.4246535e-10 4.0462766e-10 4.4051079e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.5e-06 -4e-07 2.2e-06 ] [ 2.9e-06 -2.2e-06 2.7e-06 ] [ -2.6e-06 1.1e-06 -3.3e-06 ] [ -1.8e-06 1.4e-06 -1.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.4032649312e-15 -6.408706483200001e-16 3.52478856576e-15 ] [ 4.646312200320001e-15 -3.52478856576e-15 4.32587687616e-15 ] [ -4.16565921408e-15 1.76239428288e-15 -5.28718284864e-15 ] [ -2.88391791744e-15 2.24304726912e-15 -2.4032649312e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.6375609 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.383889813471621e-18 } }