{ "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" [ 5.4737 0 0 ] "si-unit" "m" "si-value" [ 5.4737e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00330015 5.48579 0 ] "si-unit" "m" "si-value" [ -3.30015e-13 5.48579e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0734366 -0.160082 5.49307 ] "si-unit" "m" "si-value" [ 7.34366e-12 -1.60082e-11 5.49307e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.150853 0.00970189 0.0764733 ] [ 1.36952 1.32009 1.51972 ] [ 0.0340703 2.70337 2.97189 ] [ 1.37909 3.89909 4.39384 ] [ 2.73154 -0.0872152 2.86586 ] [ 4.10719 1.23544 4.14892 ] [ 2.70311 2.76853 0.030971 ] [ 4.04883 4.00647 1.36661 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.50853e-11 9.70189e-13 7.647329999999999e-12 ] [ 1.36952e-10 1.32009e-10 1.51972e-10 ] [ 3.40703e-12 2.70337e-10 2.97189e-10 ] [ 1.37909e-10 3.89909e-10 4.39384e-10 ] [ 2.73154e-10 -8.72152e-12 2.86586e-10 ] [ 4.10719e-10 1.23544e-10 4.148920000000001e-10 ] [ 2.70311e-10 2.76853e-10 3.0971e-12 ] [ 4.04883e-10 4.00647e-10 1.36661e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7354635 -0.210443 1.2229455 ] [ -0.6184209 0.5179991 -0.6458892 ] [ -0.8758048 -1.4145339 -2.7145666 ] [ -0.2764033 3.2934771 -3.1439124 ] [ -0.6863655 -1.4734019 -0.5835825 ] [ 0.2010369 0.5830078 1.1065705 ] [ -0.2658376 -2.8831245 2.0708275 ] [ 0.7863317 1.5870193 2.6876072 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.780519045951741e-09 -3.371668546110144e-10 1.959374688612566e-09 ] [ -9.908195077940948e-10 8.299260476154413e-10 -1.034828575867216e-09 ] [ -1.40319397494442e-09 -2.266333143909045e-09 -4.349215142124545e-09 ] [ -4.428469051719687e-10 5.276732010760184e-09 -5.037102945123218e-09 ] [ -1.099678757423702e-09 -2.360650077222299e-09 -9.35002237808016e-10 ] [ 3.220966210981075e-10 9.340814669040421e-10 1.772921384366966e-09 ] [ -4.259187876495821e-10 -4.61927466875569e-09 3.317831406209712e-09 ] [ 1.259842265933919e-09 2.542685219218382e-09 4.30602142173375e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.779104 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.732444394197176e-18 } }