{ "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" [ [ -1.704389 -0.7389488 -0.5877051 ] [ 0.392995 0.3755982 -0.1108001 ] [ 2.2245263 1.9781726 -0.7470235 ] [ -1.0266581 -2.4823502 0.0139157 ] [ 0.4420141 -0.7618266 0.0480313 ] [ 0.5229301 2.2071037 1.3750934 ] [ -0.8514185 -0.5777489 0.0084884 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.730732208548691e-09 -1.183926491328215e-09 -9.41607371144926e-10 ] [ 6.296474010912961e-10 6.017746548545626e-10 -1.775213298023021e-10 ] [ 3.564084030214727e-09 3.16938189162715e-09 -1.196863586888189e-09 ] [ -1.644887605374948e-09 -3.977163455078205e-09 2.229540920206656e-11 ] [ 7.081846570839533e-10 -1.220580767623553e-09 7.695462592663103e-11 ] [ 8.378263805326061e-10 3.536169947821177e-09 2.203142496896383e-09 ] [ -1.364122815216605e-09 -9.256557802729172e-10 1.359991602799872e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -16.579285 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.656294281658013e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0149849 1.9251971 1.1287946 ] [ 2.3434307 3.9750665 2.0621761 ] [ 5.279668 2.7273023 1.5812539 ] [ 3.4525342 0.3949259 2.8582468 ] [ 5.4730562 1.3470196 3.5898032 ] [ 5.0144859 3.346787 4.7364504 ] [ 4.4524241 4.6416056 2.8571676 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0149849e-10 1.9251971e-10 1.1287946e-10 ] [ 2.3434307e-10 3.9750665e-10 2.0621761e-10 ] [ 5.279668e-10 2.7273023e-10 1.5812539e-10 ] [ 3.4525342e-10 3.949259e-11 2.8582468e-10 ] [ 5.473056200000001e-10 1.3470196e-10 3.5898032e-10 ] [ 5.014485900000001e-10 3.346787e-10 4.7364504e-10 ] [ 4.4524241e-10 4.6416056e-10 2.8571676e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.39e-05 -2.13e-05 9.6e-06 ] [ 4.3e-06 -1.96e-05 3.8e-06 ] [ -6e-06 2.07e-05 -5.13e-05 ] [ -2.4e-05 -1.23e-05 -6.5e-06 ] [ -3.71e-05 5e-07 -3.4e-06 ] [ 1.67e-05 3.03e-05 1.96e-05 ] [ 1.21e-05 1.7e-06 2.82e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.431378744512e-14 -3.412636202304e-14 1.538089555968e-14 ] [ 6.889359469440001e-15 -3.140266176767999e-14 6.08827115904e-15 ] [ -9.6130597248e-15 3.316505605055999e-14 -8.219166064704e-14 ] [ -3.84522388992e-14 -1.970677243584e-14 -1.04141480352e-14 ] [ -5.944075263168e-14 8.010883104e-16 -5.44740051072e-15 ] [ 2.675634956736e-14 4.854595161024e-14 3.140266176767999e-14 ] [ 1.938633711168e-14 2.72370025536e-15 4.518138070656001e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.352882 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.100673508550115e-18 } }