{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.45864e-10 0.0 0.0 ] "source-value" [ 5.45864 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.03818e-11 5.388390000000001e-10 0.0 ] "source-value" [ 0.103818 5.38839 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.13176e-11 7.05962e-12 5.39093e-10 ] "source-value" [ 0.113176 0.0705962 5.39093 ] } "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" [ [ 5.982232701568973e-10 -1.376300158622995e-10 -1.082563986324993e-09 ] [ -3.147183414110642e-09 -1.381930367486149e-09 1.983701016899159e-09 ] [ 8.695666209142887e-10 -2.537128390044461e-09 -7.580908566452525e-10 ] [ -2.328424377324515e-09 -1.661949504645172e-09 3.474070543304941e-09 ] [ 1.440418946552087e-09 1.992957912761155e-09 -2.871656299543356e-09 ] [ 2.817727194704889e-10 1.934287486648756e-09 3.099441274511057e-09 ] [ 2.710904631995643e-09 8.742589155836257e-10 -1.853607800078765e-09 ] [ -4.252783976542483e-10 9.171341232622062e-10 -1.991293892122792e-09 ] ] "source-value" [ [ 0.37338160000000004 -0.08590190000000002 -0.6756833000000001 ] [ -1.9643174000000005 -0.8625331000000003 1.2381288000000001 ] [ 0.5427408000000001 -1.5835510000000004 -0.4731631000000001 ] [ -1.4532882000000003 -1.0373073000000002 2.1683443000000002 ] [ 0.8990388000000002 1.2439065000000002 -1.7923469000000005 ] [ 0.17586870000000002 1.2072873000000002 1.9345191000000004 ] [ 1.6920136000000003 0.5456695000000001 -1.1569310000000002 ] [ -0.26543790000000006 0.5724301000000002 -1.2428679000000002 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 4.32489e-14 -6.72518e-15 1.22781e-12 ] [ 1.51992e-10 1.38746e-10 1.2495e-10 ] [ 1.55886e-11 2.80678e-10 2.64329e-10 ] [ 1.56947e-10 4.13166e-10 3.92938e-10 ] [ 2.77407e-10 -2.90867e-12 2.65575e-10 ] [ 4.2526e-10 1.27774e-10 3.82666e-10 ] [ 2.78396e-10 2.65139e-10 -8.71139e-12 ] [ 4.18696e-10 3.99308e-10 1.34271e-10 ] ] "source-value" [ [ 0.000432489 -6.72518e-05 0.0122781 ] [ 1.51992 1.38746 1.2495 ] [ 0.155886 2.80678 2.64329 ] [ 1.56947 4.13166 3.92938 ] [ 2.77407 -0.0290867 2.65575 ] [ 4.2526 1.27774 3.82666 ] [ 2.78396 2.65139 -0.0871139 ] [ 4.18696 3.99308 1.34271 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.819121828947132e-18 "source-value" -36.320102 } }