{ "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" [ 5.45864 0 0 ] "si-unit" "m" "si-value" [ 5.45864e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.103818 5.38839 0 ] "si-unit" "m" "si-value" [ 1.03818e-11 5.388390000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.113176 0.0705962 5.39093 ] "si-unit" "m" "si-value" [ 1.13176e-11 7.05962e-12 5.39093e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.36893940000000003 -0.08160900000000001 -0.6052476000000001 ] [ -1.5749789000000005 -0.8064344000000002 0.9872020000000002 ] [ 0.5148422000000001 -1.3969613000000003 -0.14133350000000003 ] [ -1.1259575000000002 -0.9563684000000002 1.7669620000000004 ] [ 0.6680989000000002 1.0962571000000003 -1.3834266000000002 ] [ 0.009512500000000002 1.1592193000000002 1.6719737000000003 ] [ 1.4054414000000002 0.6339719000000001 -1.0143509000000002 ] [ -0.2658979000000001 0.35192470000000003 -1.2817791000000003 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.911060811719795e-10 -1.307520318468672e-10 -9.697135545153102e-10 ] [ -2.523394371833302e-09 -1.292050341888876e-09 1.581671964407002e-09 ] [ 8.248681362412379e-10 -2.238178735022375e-09 -2.264412294358368e-10 ] [ -1.803982782514416e-09 -1.532271091351903e-09 2.83098520624201e-09 ] [ 1.070412437962197e-09 1.756397496006008e-09 -2.216493755112834e-09 ] [ 1.524070510536e-11 1.857274060840142e-09 2.678797172732473e-09 ] [ 2.251765352984421e-09 1.015734956424156e-09 -1.625169297267439e-09 ] [ -4.260153988998164e-10 5.638455266220538e-10 -2.053636507050066e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.449193 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.839804487162702e-18 } }