{ "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" [ 5.47211 0 0 ] "si-unit" "m" "si-value" [ 5.47211e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.102197 5.35978 0 ] "si-unit" "m" "si-value" [ 1.02197e-11 5.35978e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0185088 0.0167086 5.27242 ] "si-unit" "m" "si-value" [ 1.85088e-12 1.67086e-12 5.27242e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0278677 0.000879346 0.114128 ] [ 1.32251 1.35955 1.26618 ] [ 0.0215185 2.57215 2.76138 ] [ 1.39174 4.08684 3.88021 ] [ 2.74481 0.155651 2.83937 ] [ 4.07982 1.36064 4.14567 ] [ 2.72904 2.76199 -0.16614 ] [ 4.049 4.11184 1.31405 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.78677e-12 8.79346e-14 1.14128e-11 ] [ 1.32251e-10 1.35955e-10 1.26618e-10 ] [ 2.15185e-12 2.57215e-10 2.76138e-10 ] [ 1.39174e-10 4.08684e-10 3.88021e-10 ] [ 2.74481e-10 1.55651e-11 2.83937e-10 ] [ 4.07982e-10 1.36064e-10 4.14567e-10 ] [ 2.72904e-10 2.76199e-10 -1.6614e-11 ] [ 4.049000000000001e-10 4.11184e-10 1.31405e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.238352 -0.7461649 -1.2794873 ] [ 2.2211368 1.2632256 2.2915064 ] [ -1.5755591 2.7150647 -2.7564727 ] [ -0.0263977 -0.1146528 1.5335653 ] [ -1.4755548 -1.7960295 -4.3604635 ] [ 2.3039693 -0.0108118 -2.1483752 ] [ -0.9849855 0.2589651 4.8041599 ] [ 1.7757431 -1.5695964 1.9155671 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.586235243520922e-09 -1.19548795804157e-09 -2.049964638670516e-09 ] [ 3.558653452558525e-09 2.023910523116052e-09 3.671397980493573e-09 ] [ -2.524323954708689e-09 4.350013186299366e-09 -4.416356115813453e-09 ] [ -4.229377778289216e-11 -1.836940356692583e-10 2.457042470130138e-09 ] [ -2.36409940326922e-09 -2.877556475167113e-09 -6.986232675551741e-09 ] [ 3.691365747500942e-09 -1.732241318876544e-11 -3.442076518146524e-09 ] [ -1.578120739926998e-09 4.149078288231341e-10 7.697112674364866e-09 ] [ 2.845054079366917e-09 -2.514770656171845e-09 3.069076823193656e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.696962 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.559066132918601e-18 } }