{ "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" [ 5.3952 0 0 ] "si-unit" "m" "si-value" [ 5.3952e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00461172 5.6034 0 ] "si-unit" "m" "si-value" [ 4.61172e-13 5.6034e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.071329 0.0469434 5.27588 ] "si-unit" "m" "si-value" [ 7.132900000000001e-12 4.694340000000001e-12 5.27588e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0148313 -0.0405976 0.0741579 ] [ 1.40662 1.33729 1.44565 ] [ 0.021393 2.68696 2.73819 ] [ 1.3197 4.02815 4.06112 ] [ 2.69728 0.0386556 2.72588 ] [ 4.00631 1.34667 3.9586 ] [ 2.7243 2.85873 -0.0805011 ] [ 4.14392 4.06243 1.15826 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.48313e-12 -4.05976e-12 7.41579e-12 ] [ 1.40662e-10 1.33729e-10 1.44565e-10 ] [ 2.1393e-12 2.68696e-10 2.73819e-10 ] [ 1.3197e-10 4.02815e-10 4.06112e-10 ] [ 2.69728e-10 3.86556e-12 2.72588e-10 ] [ 4.00631e-10 1.34667e-10 3.9586e-10 ] [ 2.7243e-10 2.85873e-10 -8.050110000000001e-12 ] [ 4.14392e-10 4.06243e-10 1.15826e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0164630000000001 1.3516440000000003 -1.2545999000000003 ] [ -1.6462881000000005 -0.6849214000000001 -0.8572978000000002 ] [ -0.3155893000000001 1.0396316000000003 -1.5291315000000005 ] [ -1.7507766000000005 1.3850581000000002 -0.11659880000000003 ] [ 0.12848280000000004 -0.6151961000000001 -0.24302750000000006 ] [ 1.0297051000000002 -0.22614790000000007 1.6426919000000004 ] [ 1.1279369000000001 -1.1586615000000002 0.22002140000000006 ] [ 0.4100663000000001 -1.0914068000000001 2.1379422000000003 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.628553267925542e-09 2.165572434286296e-09 -2.010090644798737e-09 ] [ -2.637644326652256e-09 -1.097365063206568e-09 -1.373542503539605e-09 ] [ -5.056298024004163e-10 1.665673457488035e-09 -2.449938759613372e-09 ] [ -2.805053359873965e-09 2.219107724552435e-09 -1.868118729124392e-10 ] [ 2.058521400308952e-10 -9.856528167479274e-10 -3.89372981919435e-10 ] [ 1.649769451130633e-09 -3.623288812081687e-10 2.631882579041065e-09 ] [ 1.807154145806394e-09 -1.856380382015391e-09 3.525131460599676e-10 ] [ 6.569986442508344e-10 -1.748626473148711e-09 3.425361037682555e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -30.543914 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.893674532170547e-18 } }