{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 3.052782 0.533749 2.863364 ] [ 2.918449 2.894241 2.581593 ] [ 2.15775 1.828991 4.761683 ] [ 4.980199 1.864144 2.667187 ] [ 4.882978 3.954202 1.645371 ] [ 4.390119 4.230009 4.149708 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.052782e-10 5.33749e-11 2.863364e-10 ] [ 2.918449e-10 2.894241e-10 2.581593e-10 ] [ 2.15775e-10 1.828991e-10 4.761683e-10 ] [ 4.980199e-10 1.864144e-10 2.667187e-10 ] [ 4.882978e-10 3.954202e-10 1.645371e-10 ] [ 4.390119000000001e-10 4.230009e-10 4.149708000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.5927105 -10.8577762 -0.6432105 ] [ -15.3000933 8.5302035 -1.0963375 ] [ -1.7542358 0.4541756 3.6106285 ] [ 15.3662762 -8.571861 2.2919147 ] [ 4.9297225 8.7648637 -6.8013137 ] [ 0.3510409 1.6803944 2.6383185 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.756156815826456e-09 -1.739607532484131e-08 -1.030536833843457e-09 ] [ -2.451345198327995e-08 1.366689273096502e-08 -1.756526325477975e-09 ] [ -2.810595609286297e-09 7.276695340529303e-10 5.784864616754468e-09 ] [ 2.461948867923031e-08 -1.373363540409587e-08 3.672052179461119e-09 ] [ 7.898286201604063e-09 1.404285982033478e-08 -1.089690589064408e-08 ] [ 5.624295275583305e-10 2.692288643584449e-09 4.227052253749929e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.415498 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.149399742907373e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1419781 0.4869856 2.8503744 ] [ 2.6723629 3.1681489 2.8347593 ] [ 1.7052747 1.5621212 4.7020498 ] [ 5.2725133 1.886288 2.8899264 ] [ 4.825703 3.9649281 1.3284582 ] [ 4.764445 4.2368643 4.0633379 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1419781e-10 4.869856000000001e-11 2.850374400000001e-10 ] [ 2.6723629e-10 3.1681489e-10 2.8347593e-10 ] [ 1.7052747e-10 1.5621212e-10 4.7020498e-10 ] [ 5.2725133e-10 1.886288e-10 2.8899264e-10 ] [ 4.825703e-10 3.9649281e-10 1.3284582e-10 ] [ 4.764445e-10 4.2368643e-10 4.0633379e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.5e-05 -1.82e-05 -4e-07 ] [ -9.6e-06 -7.7e-06 -2.83e-05 ] [ -1.83e-05 2.3e-05 1.99e-05 ] [ -1.51e-05 -2.24e-05 -7.5e-06 ] [ -7.1e-06 2.77e-05 -3e-06 ] [ 1.51e-05 -2.5e-06 1.92e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.607618218999999e-14 -2.915961473879999e-14 -6.408706536e-16 ] [ -1.53808956864e-14 -1.23367600818e-14 -4.53415987422e-14 ] [ -2.93198324022e-14 3.6850062582e-14 3.18833150166e-14 ] [ -2.41928671734e-14 -3.588875660159999e-14 -1.2016324755e-14 ] [ -1.13754541014e-14 4.438029276179999e-14 -4.806529901999999e-15 ] [ 2.41928671734e-14 -4.005441585e-15 3.076179137279999e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.190867 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.074715869360168e-18 } }