{ "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" [ 5.47613 0 0 ] "si-unit" "m" "si-value" [ 5.476130000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0968569 5.44973 0 ] "si-unit" "m" "si-value" [ -9.68569e-12 5.44973e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0334568 0.0277585 5.60527 ] "si-unit" "m" "si-value" [ -3.34568e-12 2.77585e-12 5.60527e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.000509808 0.0158858 0.00549688 ] [ 1.34999 1.33014 1.19729 ] [ 0.0276425 2.69054 2.64154 ] [ 1.36667 4.13087 4.06954 ] [ 2.77416 0.0351576 2.5647 ] [ 4.07457 1.31666 4.03649 ] [ 2.84869 2.60665 0.046702 ] [ 4.10529 4.27129 1.35792 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.098080000000001e-14 1.58858e-12 5.49688e-13 ] [ 1.34999e-10 1.33014e-10 1.19729e-10 ] [ 2.76425e-12 2.69054e-10 2.64154e-10 ] [ 1.36667e-10 4.13087e-10 4.06954e-10 ] [ 2.77416e-10 3.51576e-12 2.5647e-10 ] [ 4.07457e-10 1.31666e-10 4.03649e-10 ] [ 2.84869e-10 2.60665e-10 4.6702e-12 ] [ 4.10529e-10 4.27129e-10 1.35792e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5743935 -0.1910114 -2.9277023 ] [ 0.3360348 0.6140552 1.4982976 ] [ -0.361246 0.6759509 0.5252045 ] [ -0.0719154 -0.624578 0.8074378 ] [ -0.9139758 0.2928109 1.3518168 ] [ 0.5530413 0.6038798 0.5815105 ] [ -0.1901941 1.421436 -1.7994698 ] [ 0.0738617 -2.7925434 -0.0370949 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.202798368394849e-10 -3.060339993862771e-10 -4.690696177722388e-09 ] [ 5.383871003352039e-10 9.838248853206683e-10 2.40053738572075e-09 ] [ -5.787798955575168e-10 1.082992728788719e-09 8.414703710389535e-10 ] [ -1.152211725554803e-10 -1.000684269466022e-09 1.293657965910186e-09 ] [ -1.464350658736977e-09 4.691347782954067e-10 2.16584927256467e-09 ] [ 8.86069841196839e-10 9.675220973333798e-10 9.316825278497185e-10 ] [ -3.047245404340973e-10 2.277391527163469e-09 -2.883068443395652e-09 ] [ 1.183394889125434e-10 -4.474147748049343e-09 -5.943258153091393e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -35.707562 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.72098210221665e-18 } }