{ "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" [ 5.42333 0 0 ] "si-unit" "m" "si-value" [ 5.423330000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0707092 5.40512 0 ] "si-unit" "m" "si-value" [ 7.07092e-12 5.40512e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00203562 -0.0726392 5.50089 ] "si-unit" "m" "si-value" [ -2.03562e-13 -7.26392e-12 5.50089e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00542909 0.0277818 -0.0388963 ] [ 1.35422 1.36306 1.38504 ] [ 0.0297601 2.72434 2.72311 ] [ 1.36125 4.06894 4.03995 ] [ 2.72846 0.00923744 2.71344 ] [ 4.08711 1.36473 3.96445 ] [ 2.72619 2.69674 -0.100972 ] [ 4.11061 4.07011 1.39355 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.42909e-13 2.77818e-12 -3.88963e-12 ] [ 1.35422e-10 1.36306e-10 1.38504e-10 ] [ 2.97601e-12 2.72434e-10 2.72311e-10 ] [ 1.36125e-10 4.06894e-10 4.03995e-10 ] [ 2.72846e-10 9.23744e-13 2.71344e-10 ] [ 4.08711e-10 1.36473e-10 3.96445e-10 ] [ 2.72619e-10 2.69674e-10 -1.00972e-11 ] [ 4.11061e-10 4.07011e-10 1.39355e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6418882 0.4833767 0.0853546 ] [ 0.3700108 0.0514442 -1.006175 ] [ -0.0076848 0.0586448 -0.3694743 ] [ 0.8612087 -0.2901133 0.5622256 ] [ -0.6918792 -0.1019991 -0.0520695 ] [ 0.2917698 -0.5548241 1.5311298 ] [ -0.1212216 0.6659812 0.7286612 ] [ -0.0603154 -0.3125104 -1.4796524 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.028418275680319e-09 7.744548541600277e-10 1.367531457244164e-10 ] [ 5.928226580876471e-10 8.24226951948228e-11 -1.61207007471495e-09 ] [ -1.23124069969632e-11 9.395932826560319e-11 -5.919630903235061e-10 ] [ 1.379808456137516e-09 -4.648127504726322e-10 9.007847193566303e-10 ] [ -1.108512687790613e-09 -1.634205747090294e-10 -8.342453624406299e-11 ] [ 4.674667560668532e-10 -8.889262090000793e-10 2.453140389181093e-09 ] [ -1.942184150560944e-10 1.067019517323281e-09 1.167443948742401e-09 ] [ -9.663592455036359e-11 -5.006968607619936e-10 -2.370664501722022e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.41857029230348 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.674680573201518e-18 } }