{ "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" [ 5.4207 0 0 ] "si-unit" "m" "si-value" [ 5.420700000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.121917 5.37017 0 ] "si-unit" "m" "si-value" [ -1.21917e-11 5.37017e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0328689 -0.300504 5.4102 ] "si-unit" "m" "si-value" [ -3.28689e-12 -3.00504e-11 5.4102e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0512752 -0.33658 -0.135216 ] [ 1.26577 1.35967 1.6251 ] [ 0.0338464 2.52642 2.69707 ] [ 1.45988 3.83229 4.06608 ] [ 2.77794 -0.093605 2.9072 ] [ 4.03914 1.38604 3.72159 ] [ 2.13334 2.58123 0.377362 ] [ 4.24352 4.40881 1.44889 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.12752e-12 -3.3658e-11 -1.35216e-11 ] [ 1.26577e-10 1.35967e-10 1.6251e-10 ] [ 3.38464e-12 2.52642e-10 2.69707e-10 ] [ 1.45988e-10 3.83229e-10 4.06608e-10 ] [ 2.77794e-10 -9.3605e-12 2.9072e-10 ] [ 4.03914e-10 1.38604e-10 3.72159e-10 ] [ 2.13334e-10 2.58123e-10 3.77362e-11 ] [ 4.243520000000001e-10 4.40881e-10 1.44889e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9438459999999999 3.8109981999999993 -2.9246975999999996 ] [ 0.6291233999999999 -8.614057399999998 2.0522321999999997 ] [ -0.9083137999999998 4.772151899999999 2.2791547999999997 ] [ -0.38391739999999996 -2.7014432999999998 0.30333629999999995 ] [ -1.6445404999999997 -0.5617472999999998 -3.3994473999999997 ] [ -0.7879153999999999 0.7980426999999999 3.9976705999999997 ] [ 4.963421199999999 5.271668499999999 -6.466068999999999 ] [ -2.8117035999999995 -2.7756132999999994 4.157819899999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.512208007294364e-09 6.105892268256057e-09 -4.685882156235877e-09 ] [ 1.007966811382635e-09 -1.380124149021479e-08 3.288038478382414e-09 ] [ -1.455279146699749e-09 7.645830268078701e-09 3.651608565828942e-09 ] [ -6.151034876660314e-10 -4.328189333335852e-09 4.85998332104014e-10 ] [ -2.634844362766676e-09 -9.000183982725879e-10 -5.44651519279205e-09 ] [ -1.262379643448763e-09 1.278605366874272e-09 6.40497442574876e-09 ] [ 7.952277471340238e-09 8.446144092893827e-09 -1.035978466563174e-08 ] [ -4.504845809653681e-09 -4.44702277427963e-09 6.661561892160214e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.536013 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.610667345212024e-18 } }