{ "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" [ [ 1.707964 2.049797 2.376981 ] [ 0.4160118 4.05664 2.341909 ] [ 2.458635 3.954401 1.032866 ] [ 3.928295 2.199643 0.7405181 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.707964e-10 2.049797e-10 2.376981e-10 ] [ 4.160118e-11 4.05664e-10 2.341909e-10 ] [ 2.458635e-10 3.954401e-10 1.032866e-10 ] [ 3.928295e-10 2.199643e-10 7.405181e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1681234 0.2204625 -0.9210694 ] [ 0.2815468 -0.1498157 -0.1283508 ] [ -0.2012119 0.0285649 0.1308126 ] [ -1.2484582 -0.0992117 0.9186075 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.871540001689407e-09 3.5321986326312e-10 -1.475715858814284e-09 ] [ 4.510877006210534e-10 -2.400312119687865e-10 -2.056406510209766e-10 ] [ -3.223770020067475e-10 4.576601495548992e-11 2.095848894260621e-10 ] [ -2.00025054008605e-09 -1.589546662498234e-10 1.471771460191536e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.541117 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.849090783531743e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1004339 2.2159971 2.6493967 ] [ 0.4227666 3.7085056 1.8608172 ] [ 2.6914369 4.2488753 1.3863009 ] [ 3.2962683 2.0871029 0.5957594 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1004339e-10 2.2159971e-10 2.6493967e-10 ] [ 4.227666e-11 3.7085056e-10 1.8608172e-10 ] [ 2.6914369e-10 4.2488753e-10 1.3863009e-10 ] [ 3.2962683e-10 2.0871029e-10 5.957594000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.15e-05 -6e-07 -2.24e-05 ] [ 3.9e-06 -8.9e-06 -4.38e-05 ] [ 1.17e-05 -2.21e-05 2.04e-05 ] [ -7.71e-05 3.16e-05 4.58e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.853386217920001e-14 -9.6130597248e-16 -3.588875630592e-14 ] [ 6.24848882112e-15 -1.425937192512e-14 -7.017533599104001e-14 ] [ 1.874546646336e-14 -3.540810331968e-14 3.268440306432e-14 ] [ -1.2352781746368e-13 5.062878121728e-14 7.337968923264e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.031003 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.927579173137467e-18 } }