{ "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" [ 5.05932 0 0 ] "si-unit" "m" "si-value" [ 5.059319999999999e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.224512 5.44129 0 ] "si-unit" "m" "si-value" [ 2.24512e-11 5.441290000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.327401 0.688972 5.24092 ] "si-unit" "m" "si-value" [ 3.27401e-11 6.88972e-11 5.24092e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.119472 0.0796179 0.152764 ] [ 1.48092 1.5486 0.772169 ] [ 0.0612704 2.84226 2.7863 ] [ 1.84412 4.4971 3.9905 ] [ 2.88701 0.305191 2.51679 ] [ 4.25223 1.88781 3.92663 ] [ 2.58737 2.78734 -0.624797 ] [ 3.988 4.24006 0.48768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.19472e-11 7.96179e-12 1.52764e-11 ] [ 1.48092e-10 1.5486e-10 7.72169e-11 ] [ 6.127040000000001e-12 2.84226e-10 2.786300000000001e-10 ] [ 1.84412e-10 4.4971e-10 3.9905e-10 ] [ 2.88701e-10 3.05191e-11 2.51679e-10 ] [ 4.25223e-10 1.88781e-10 3.92663e-10 ] [ 2.58737e-10 2.78734e-10 -6.247970000000001e-11 ] [ 3.988e-10 4.24006e-10 4.8768e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 8.9322085 3.8950009 -0.4047148 ] [ -1.047129 -0.34381 6.7707745 ] [ 8.0904215 9.2415711 -11.9286954 ] [ -15.7319442 12.2458213 -8.5536395 ] [ -1.0456888 1.3301819 -3.8629726 ] [ -7.1071263 -9.5278967 1.4686466 ] [ 13.3989307 -9.7917412 8.0593629 ] [ -5.4896724 -7.0491272 8.4512385 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.431097563081104e-08 6.240479379974959e-09 -6.484245906517478e-10 ] [ -1.677685602761683e-09 -5.50844343997248e-10 1.084797660860881e-08 ] [ 1.296228417971767e-08 1.480662915588094e-08 -1.91118768865245e-08 ] [ -2.520535319697016e-08 1.961996858935466e-08 -1.37044412296514e-08 ] [ -1.675378147992407e-09 2.131186341591324e-09 -6.189164386510991e-09 ] [ -1.138687159893281e-08 -1.526537333813747e-08 2.353031246737409e-09 ] [ 2.146745351125938e-08 -1.568809882756414e-08 1.291252281692289e-08 ] [ -8.795424775131025e-09 -1.129394679688537e-08 1.354037674150486e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -22.371293 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.58427626216667e-18 } }