{ "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" [ 5.4238 0 0 ] "si-unit" "m" "si-value" [ 5.4238e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0012341 5.50722 0 ] "si-unit" "m" "si-value" [ -1.2341e-13 5.507220000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00966142 -0.113973 5.43239 ] "si-unit" "m" "si-value" [ -9.661420000000001e-13 -1.13973e-11 5.43239e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0339885 -0.0385369 0.0299316 ] [ 1.35039 1.32575 1.36375 ] [ -0.105411 2.62445 2.64243 ] [ 1.34087 3.97443 4.1654 ] [ 2.65221 0.0889868 2.75972 ] [ 4.05512 1.26127 4.10909 ] [ 2.71709 2.70534 0.0564386 ] [ 4.05687 4.02913 1.37335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.39885e-12 -3.85369e-12 2.99316e-12 ] [ 1.35039e-10 1.32575e-10 1.36375e-10 ] [ -1.05411e-11 2.62445e-10 2.64243e-10 ] [ 1.34087e-10 3.97443e-10 4.1654e-10 ] [ 2.652210000000001e-10 8.89868e-12 2.75972e-10 ] [ 4.05512e-10 1.26127e-10 4.10909e-10 ] [ 2.71709e-10 2.70534e-10 5.64386e-12 ] [ 4.05687e-10 4.02913e-10 1.37335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2157705 -0.3780042 0.0938925 ] [ -0.7531747 0.4339389 -0.4352835 ] [ 1.5231794 0.2395078 1.9038308 ] [ -0.315939 0.598697 -1.6001238 ] [ 0.2977537 -3.35185 0.136435 ] [ 0.2442952 0.6417565 0.1197624 ] [ -0.3466748 -0.0603982 -0.4751023 ] [ -0.8652103 1.8763521 0.2565888 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.45702453406497e-10 -6.056294967938627e-10 1.50432369607845e-10 ] [ -1.20671890565996e-09 6.952467661636626e-10 -6.974010528657389e-10 ] [ 2.440402444070139e-09 3.837338008207451e-10 3.050273222849527e-09 ] [ -5.06190083569326e-10 9.59218344245898e-10 -2.563680963867289e-09 ] [ 4.770540208270458e-10 -5.3702557506729e-09 2.1859296905979e-10 ] [ 3.914040612383567e-10 1.028207269017621e-09 1.918805189117616e-10 ] [ -5.554342641566232e-10 -9.676858477565879e-11 -7.61197803819658e-10 ] [ -1.38621972615613e-09 3.006247491776831e-09 4.111005799060992e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.365915 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.826461928703011e-18 } }