{ "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" [ [ 1.864683 1.866161 1.825326 ] [ 1.617619 4.144917 1.356057 ] [ 3.090269 3.905988 2.739114 ] [ 3.727671 1.752123 3.16656 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.864683e-10 1.866161e-10 1.825326e-10 ] [ 1.617619e-10 4.144917000000001e-10 1.356057e-10 ] [ 3.090269e-10 3.905988e-10 2.739114e-10 ] [ 3.727671e-10 1.752123e-10 3.16656e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.7289406 -7.2691608 -6.0874173 ] [ 4.4619527 -3.7294625 4.4718821 ] [ 1.9936051 11.4882324 0.735958 ] [ 1.2733828 -0.489609 0.8795773 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.238312793287192e-08 -1.164647948659582e-08 -9.75311767911346e-09 ] [ 7.148836299055437e-09 -5.97525762565032e-09 7.164744951594008e-09 ] [ 3.194107482327646e-09 1.840617736559708e-08 1.179134701490727e-09 ] [ 2.040184151488842e-09 -7.844400931332672e-10 1.409238186246388e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.6120443 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.991486172353903e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6195324 1.5487305 1.5722159 ] [ 1.713448 4.0304416 1.5436553 ] [ 3.2736979 4.2497746 2.7697153 ] [ 3.6935637 1.8402423 3.2014705 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6195324e-10 1.5487305e-10 1.5722159e-10 ] [ 1.713448e-10 4.0304416e-10 1.5436553e-10 ] [ 3.2736979e-10 4.2497746e-10 2.7697153e-10 ] [ 3.6935637e-10 1.8402423e-10 3.2014705e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.56e-05 -3.44e-05 -6.91e-05 ] [ 7.26e-05 -1.15e-05 0.0001787 ] [ -2.72e-05 1.92e-05 -0.0001431 ] [ -7.11e-05 2.68e-05 3.35e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.101572149248001e-14 -5.511487575552001e-14 -1.1071040449728e-13 ] [ 1.1631802267008e-13 -1.84250311392e-14 2.8630896213696e-13 ] [ -4.357920408576e-14 3.076179111936e-14 -2.2927147443648e-13 ] [ -1.1391475773888e-13 4.293833343744e-14 5.36729167968e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.6084473 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.379225300544888e-18 } }