{ "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" [ [ 2.254281 5.296227 1.418577 ] [ 1.750413 3.136093 1.98753 ] [ 3.34497 1.45321 1.881533 ] [ 3.803004 3.670054 2.106009 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.254281e-10 5.296227e-10 1.418577e-10 ] [ 1.750413e-10 3.136093e-10 1.98753e-10 ] [ 3.34497e-10 1.45321e-10 1.881533e-10 ] [ 3.803004e-10 3.670054e-10 2.106009e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.309294 5.0869238 -1.7214783 ] [ -9.8118632 -2.3619068 0.5864297 ] [ 1.6091412 -5.6174997 -0.5216732 ] [ 9.512016 2.8924828 1.6567218 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.097720253836396e-09 8.150150451298488e-09 -2.758112308198042e-09 ] [ -1.572033795504447e-08 -3.784191886645711e-09 9.3956396282363e-10 ] [ 2.578128431446721e-09 -9.000226760842008e-09 -8.358126116240086e-10 ] [ 1.523992977743414e-08 4.634268356406895e-09 2.654360956998421e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.6196527 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.220802951513501e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3309204 5.0606459 1.593272 ] [ 1.3577936 2.992989 1.825473 ] [ 3.2530526 1.7060572 1.9928404 ] [ 4.2109014 3.7958919 1.9820636 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3309204e-10 5.0606459e-10 1.593272e-10 ] [ 1.3577936e-10 2.992989e-10 1.825473e-10 ] [ 3.2530526e-10 1.7060572e-10 1.9928404e-10 ] [ 4.2109014e-10 3.7958919e-10 1.9820636e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0130883 0.0307437 0.0190781 ] [ -0.1263368 -0.0380235 -0.0260418 ] [ 0.0253487 -0.0149579 0.0244987 ] [ 0.0878997 0.0222378 -0.0175349 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.09697684387822e-11 4.925683778270579e-11 3.05664860411154e-11 ] [ -2.024138689743312e-10 -6.092036324289899e-11 -4.17235634673012e-11 ] [ 4.061309484227579e-11 -2.39651978737086e-11 3.92512447033758e-11 ] [ 1.408308454756098e-10 3.562888355156519e-11 -2.80940070595266e-11 ] ] } "relaxed-potential-energy" { "source-value" -11.599553 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.85845327814446e-18 } }