{ "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" [ 5.43182 0 0 ] "si-unit" "m" "si-value" [ 5.43182e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00436542 5.42411 0 ] "si-unit" "m" "si-value" [ -4.36542e-13 5.42411e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.250705 -0.013062 5.36378 ] "si-unit" "m" "si-value" [ 2.50705e-11 -1.3062e-12 5.36378e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00336868 -0.0347308 0.0739509 ] [ 1.33721 1.36002 1.29514 ] [ 0.0804819 2.71297 2.74807 ] [ 1.4297 4.00589 4.14244 ] [ 2.76212 -0.0429027 2.66501 ] [ 4.31635 1.33651 3.99144 ] [ 2.62716 2.67896 0.144482 ] [ 3.97118 3.97277 1.25678 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.36868e-13 -3.47308e-12 7.395090000000001e-12 ] [ 1.33721e-10 1.36002e-10 1.29514e-10 ] [ 8.04819e-12 2.71297e-10 2.74807e-10 ] [ 1.4297e-10 4.00589e-10 4.14244e-10 ] [ 2.76212e-10 -4.29027e-12 2.66501e-10 ] [ 4.31635e-10 1.33651e-10 3.99144e-10 ] [ 2.62716e-10 2.67896e-10 1.44482e-11 ] [ 3.97118e-10 3.97277e-10 1.25678e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0907423 0.7338372 -0.8176549 ] [ -0.2037324 -1.4920657 3.0483303 ] [ -0.0760536 0.8999291 -1.9514412 ] [ 1.9302214 -0.3380331 -1.1570011 ] [ -0.1498569 0.495381 0.4709672 ] [ -2.1797388 -1.5176864 1.8960519 ] [ 0.2011932 -0.3276753 -4.531424 ] [ 2.5687094 1.5463133 3.0421718 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.349738460775418e-09 1.175736814999985e-09 -1.310027575455606e-09 ] [ -3.264152908687416e-10 -2.390552800932853e-09 4.883963579374209e-09 ] [ -1.218513008515824e-10 1.441845376276649e-09 -3.126553493264921e-09 ] [ 3.092555625526767e-09 -5.415887343385853e-10 -1.853720127932297e-09 ] [ -2.400972236236745e-10 7.936878631275539e-10 7.545726432204047e-10 ] [ -3.492326573583199e-09 -2.431601687819578e-09 3.037810051031305e-09 ] [ 3.223470439596888e-10 -5.249937091989401e-10 -7.260141651546816e-09 ] [ 4.115526180216159e-09 2.477467038103432e-09 4.874096574573721e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.73131 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.724786998421054e-18 } }