{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.44714e-10 0.0 0.0 ] "source-value" [ 5.44714 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.03058e-11 5.37075e-10 0.0 ] "source-value" [ 0.103058 5.37075 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 4.54409e-12 8.808560000000001e-13 5.432070000000001e-10 ] "source-value" [ 0.0454409 0.00880856 5.43207 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 3.227139397501017e-10 7.307163232505231e-09 3.674203712191918e-09 ] [ 2.183663986563708e-08 -2.186242577682522e-08 -1.948111659338368e-08 ] [ -2.303730990374097e-08 1.961102123401581e-08 2.059686662427297e-08 ] [ 3.039661501306416e-09 -1.009907535640748e-08 8.117738671547635e-10 ] [ -2.635668020059496e-09 4.263307072587898e-09 4.301850795772146e-09 ] [ 5.275140889158067e-10 -1.32127035844604e-09 1.822332030699452e-09 ] [ -1.775589008440598e-09 5.463131161436001e-09 -6.471390842400489e-09 ] [ 1.722037376413993e-09 -3.36185104864853e-09 -5.254519594307075e-09 ] ] "source-value" [ [ 0.20142220000000005 4.560772600000001 2.2932576000000005 ] [ 13.629358700000003 -13.645453000000003 -12.159156700000004 ] [ -14.378758000000003 12.240236800000003 12.855553100000003 ] [ 1.8972075000000004 -6.303347100000002 0.5066694000000002 ] [ -1.6450546000000004 2.6609470000000006 2.6850041000000004 ] [ 0.32924840000000005 -0.8246721000000002 1.1374102000000001 ] [ -1.1082355000000002 3.409818300000001 -4.039124500000001 ] [ 1.0748112000000003 -2.0983024000000006 -3.279613200000001 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -9.227900000000001e-12 -1.565e-11 1.40236e-11 ] [ 1.30169e-10 1.48453e-10 1.67094e-10 ] [ -6.4284e-12 2.41697e-10 2.49469e-10 ] [ 1.35107e-10 4.20911e-10 4.05148e-10 ] [ 2.6753e-10 4.24873e-12 2.71018e-10 ] [ 4.05146e-10 1.3988e-10 4.09778e-10 ] [ 2.74223e-10 2.69898e-10 4.20733e-11 ] [ 4.21922e-10 4.15138e-10 1.78205e-10 ] ] "source-value" [ [ -0.092279 -0.1565 0.140236 ] [ 1.30169 1.48453 1.67094 ] [ -0.064284 2.41697 2.49469 ] [ 1.35107 4.20911 4.05148 ] [ 2.6753 0.0424873 2.71018 ] [ 4.05146 1.3988 4.09778 ] [ 2.74223 2.69898 0.420733 ] [ 4.21922 4.15138 1.78205 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.674436328068537e-18 "source-value" -29.175537 } }