{ "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" [ [ 2.875077 1.739271 0.5500127 ] [ 2.247142 4.095662 1.890424 ] [ 4.370849 2.938246 1.693427 ] [ 3.902852 1.049683 3.036341 ] [ 5.923496 0.662055 4.457524 ] [ 5.031061 2.817229 4.209838 ] [ 4.680107 5.055758 2.976326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.875077e-10 1.739271e-10 5.500127000000001e-11 ] [ 2.247142e-10 4.095662e-10 1.890424e-10 ] [ 4.370849e-10 2.938246e-10 1.693427e-10 ] [ 3.902852e-10 1.049683e-10 3.036341e-10 ] [ 5.923496e-10 6.62055e-11 4.457524e-10 ] [ 5.031061e-10 2.817229e-10 4.209838000000001e-10 ] [ 4.680106999999999e-10 5.055758e-10 2.976326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2654223 -1.1115949 -1.6109975 ] [ 0.0807782 0.1513397 -0.0829423 ] [ 0.5195027 2.2477802 0.9972095 ] [ -0.1401283 -0.4657749 0.2784475 ] [ 0.507566 -0.2008553 0.3371664 ] [ 0.1147773 0.1085267 0.561315 ] [ 0.1829264 -0.7294215 -0.4801985 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.027430041202538e-09 -1.780971375253566e-09 -2.581102551932415e-09 ] [ 1.294209445765788e-10 2.424729311365698e-10 -1.328882150302182e-10 ] [ 8.323350872399116e-10 3.601340914807846e-09 1.597705760102823e-09 ] [ -2.245102880221422e-10 -7.462536614836865e-10 4.46122078295715e-10 ] [ 8.132103854128439e-10 -3.218056684750601e-10 5.402001278498976e-10 ] [ 1.838935081736082e-10 1.738789429051278e-10 8.993257773137099e-10 ] [ 2.930804038217375e-10 -1.168662083637231e-09 -7.693628163818488e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -11.274459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.806367477079101e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.4129535 2.0687732 -0.327977 ] [ 1.4020119 4.4231524 1.8646146 ] [ 3.3837211 3.2233423 1.6879683 ] [ 3.5343816 1.713499 3.4474103 ] [ 7.0282977 0.5127936 5.2333257 ] [ 5.0836868 1.7284124 5.1407168 ] [ 5.1855313 4.6879312 1.7678339 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.4129535e-10 2.0687732e-10 -3.27977e-11 ] [ 1.4020119e-10 4.4231524e-10 1.8646146e-10 ] [ 3.3837211e-10 3.2233423e-10 1.6879683e-10 ] [ 3.5343816e-10 1.713499e-10 3.4474103e-10 ] [ 7.028297700000001e-10 5.127936e-11 5.233325700000001e-10 ] [ 5.0836868e-10 1.7284124e-10 5.1407168e-10 ] [ 5.1855313e-10 4.6879312e-10 1.7678339e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6e-07 -2.7e-06 9e-07 ] [ 2.2e-06 5.5e-06 -9e-07 ] [ -2.6e-06 -1.7e-06 -5e-07 ] [ -1.6e-06 -2.8e-06 -3.3e-06 ] [ 7e-07 6e-07 1.7e-06 ] [ 3.6e-06 4e-07 -1.3e-06 ] [ -3e-06 7e-07 3.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.613059803999998e-16 -4.3258769118e-15 1.4419589706e-15 ] [ 3.5247885948e-15 8.811971486999999e-15 -1.4419589706e-15 ] [ -4.165659248399999e-15 -2.7237002778e-15 -8.010883169999999e-16 ] [ -2.5634826144e-15 -4.486094575199999e-15 -5.2871828922e-15 ] [ 1.1215236438e-15 9.613059803999998e-16 2.7237002778e-15 ] [ 5.767835882399999e-15 6.408706536e-16 -2.0828296242e-15 ] [ -4.806529901999999e-15 1.1215236438e-15 5.4474005556e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.276115 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.447503451129691e-18 } }