{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.4737 0 0 ] "si-unit" "m" "si-value" [ 5.4737e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00330015 5.48579 0 ] "si-unit" "m" "si-value" [ -3.30015e-13 5.48579e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0734366 -0.160082 5.49307 ] "si-unit" "m" "si-value" [ 7.34366e-12 -1.60082e-11 5.49307e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.150853 0.00970189 0.0764733 ] [ 1.36952 1.32009 1.51972 ] [ 0.0340703 2.70337 2.97189 ] [ 1.37909 3.89909 4.39384 ] [ 2.73154 -0.0872152 2.86586 ] [ 4.10719 1.23544 4.14892 ] [ 2.70311 2.76853 0.030971 ] [ 4.04883 4.00647 1.36661 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.50853e-11 9.70189e-13 7.647329999999999e-12 ] [ 1.36952e-10 1.32009e-10 1.51972e-10 ] [ 3.40703e-12 2.70337e-10 2.97189e-10 ] [ 1.37909e-10 3.89909e-10 4.39384e-10 ] [ 2.73154e-10 -8.72152e-12 2.86586e-10 ] [ 4.10719e-10 1.23544e-10 4.148920000000001e-10 ] [ 2.70311e-10 2.76853e-10 3.0971e-12 ] [ 4.04883e-10 4.00647e-10 1.36661e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0641402 0.1838755 0.7103251 ] [ -0.4677398 0.3388477 -0.5840594 ] [ -0.7376498 -0.7146335 -1.8705415 ] [ -0.445072 2.6420637 -2.0676817 ] [ -0.6057932 -1.279872 -0.4582575 ] [ 0.3189398 0.3674385 0.8575218 ] [ 0.0834676 -2.5475294 1.3905727 ] [ 0.7897071 1.0098094 2.0221206 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.704940549693436e-09 2.946010272379104e-10 1.138066268387422e-09 ] [ -7.494017721776679e-10 5.428938629518521e-10 -9.357663158384755e-10 ] [ -1.181845263897796e-09 -1.144969086140477e-09 -2.996937859536164e-09 ] [ -7.130839529726977e-10 4.233052690804345e-09 -3.312791278996e-09 ] [ -9.705877020796187e-10 -2.050580996016538e-09 -7.342094528062561e-10 ] [ 5.109978910026278e-10 5.887013742818209e-10 1.373901379786334e-09 ] [ 1.337298373142861e-10 -4.081592045480652e-09 2.227943069462732e-09 ] [ 1.265250252899768e-09 1.617893012144076e-09 3.239794349758068e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.142522 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.790670376514966e-18 } }