{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.966235 1.459279 2.017921 ] [ 1.582263 2.973277 1.988687 ] [ 1.824476 2.329709 3.996255 ] [ 2.988754 4.654766 3.111716 ] [ 4.721481 3.212435 2.659559 ] [ 3.387912 3.682172 0.4517977 ] [ 4.184602 3.482657 5.105901 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.966235e-10 1.459279e-10 2.017921e-10 ] [ 1.582263e-10 2.973277e-10 1.988687e-10 ] [ 1.824476e-10 2.329709e-10 3.996255e-10 ] [ 2.988754e-10 4.654766e-10 3.111716e-10 ] [ 4.721481e-10 3.212435e-10 2.659559e-10 ] [ 3.387912e-10 3.682172e-10 4.517977e-11 ] [ 4.184602e-10 3.482657e-10 5.105901e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -25.1914684 -24.1927315 3.4467459 ] [ 10.5754008 -28.6900447 8.1131979 ] [ -30.3730396 -11.2215872 -11.3536369 ] [ 11.8178398 31.4988434 24.7796002 ] [ 11.1665062 15.9253801 7.6446653 ] [ 2.4241857 12.0270846 -50.718443 ] [ 19.5805754 4.6530552 18.0878705 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.036118204662936e-08 -3.876102912193577e-08 5.5222957443153e-09 ] [ 1.694366005694491e-08 -4.596651924675554e-08 1.299877610239787e-08 ] [ -4.86629743506767e-08 -1.797896480823348e-08 -1.819053175210019e-08 ] [ 1.893426679191523e-08 5.046671089350511e-08 3.970129644030173e-08 ] [ 1.789071531705613e-08 2.551527188378858e-08 1.22481041184106e-08 ] [ 3.883973685016934e-09 1.926951392126123e-08 -8.125990428746085e-08 ] [ 3.13715403861552e-08 7.455016318152195e-09 2.89799634739179e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.3152472763671668 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.709435088127615e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.966235 1.459279 2.017921 ] [ 1.582263 2.973277 1.988687 ] [ 1.824476 2.329709 3.996255 ] [ 2.988754 4.654766 3.111716 ] [ 4.721481 3.212435 2.659559 ] [ 3.387912 3.682172 0.4517977 ] [ 4.184602 3.482657 5.105901 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.966235e-10 1.459279e-10 2.017921e-10 ] [ 1.582263e-10 2.973277e-10 1.988687e-10 ] [ 1.824476e-10 2.329709e-10 3.996255e-10 ] [ 2.988754e-10 4.654766e-10 3.111716e-10 ] [ 4.721481e-10 3.212435e-10 2.659559e-10 ] [ 3.387912e-10 3.682172e-10 4.517977e-11 ] [ 4.184602e-10 3.482657e-10 5.105901e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -25.1914684 -24.1927315 3.4467459 ] [ 10.5754008 -28.6900447 8.1131979 ] [ -30.3730396 -11.2215872 -11.3536369 ] [ 11.8178398 31.4988434 24.7796002 ] [ 11.1665062 15.9253801 7.6446653 ] [ 2.4241857 12.0270846 -50.718443 ] [ 19.5805754 4.6530552 18.0878705 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.036118204662936e-08 -3.876102912193577e-08 5.5222957443153e-09 ] [ 1.694366005694491e-08 -4.596651924675554e-08 1.299877610239787e-08 ] [ -4.86629743506767e-08 -1.797896480823348e-08 -1.819053175210019e-08 ] [ 1.893426679191523e-08 5.046671089350511e-08 3.970129644030173e-08 ] [ 1.789071531705613e-08 2.551527188378858e-08 1.22481041184106e-08 ] [ 3.883973685016934e-09 1.926951392126123e-08 -8.125990428746085e-08 ] [ 3.13715403861552e-08 7.455016318152195e-09 2.89799634739179e-08 ] ] } "relaxed-potential-energy" { "source-value" -2.3152472763671668 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.709435088127615e-19 } }