{ "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" [ 5.55975 0 0 ] "si-unit" "m" "si-value" [ 5.55975e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00335003 5.48819 0 ] "si-unit" "m" "si-value" [ 3.35003e-13 5.488190000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0164792 -0.0422926 5.51812 ] "si-unit" "m" "si-value" [ 1.64792e-12 -4.22926e-12 5.51812e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0695878 -0.00317054 -0.0200442 ] [ 1.39636 1.32374 1.28539 ] [ -0.0674176 2.58156 2.68412 ] [ 1.50658 3.99879 4.14654 ] [ 2.80481 -0.0668971 2.57568 ] [ 4.18687 1.32364 3.96453 ] [ 2.74594 2.77319 -0.0797703 ] [ 4.04367 4.06467 1.27465 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.958780000000001e-12 -3.17054e-13 -2.00442e-12 ] [ 1.39636e-10 1.32374e-10 1.28539e-10 ] [ -6.74176e-12 2.58156e-10 2.68412e-10 ] [ 1.50658e-10 3.99879e-10 4.14654e-10 ] [ 2.80481e-10 -6.689710000000001e-12 2.57568e-10 ] [ 4.18687e-10 1.32364e-10 3.96453e-10 ] [ 2.74594e-10 2.77319e-10 -7.97703e-12 ] [ 4.04367e-10 4.06467e-10 1.27465e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0957802 -0.3907826 -0.7224535 ] [ -0.1221227 0.1620158 -0.0806551 ] [ 1.007862 1.7110957 -0.1927249 ] [ -1.6327869 1.0491996 -1.27184 ] [ -0.9877383 0.1375945 1.1817721 ] [ -0.4341901 -0.7088354 1.0218366 ] [ 0.3189669 -1.4679667 -0.1881711 ] [ 1.7542288 -0.492321 0.2522361 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.534567971755482e-10 -6.26102745535438e-10 -1.157498107315133e-09 ] [ -1.956621348089722e-10 2.595779269602086e-10 -1.292237155682861e-10 ] [ 1.61477293339273e-09 2.741477526491411e-09 -3.087793290260179e-10 ] [ -2.616012997928508e-09 1.681003069672712e-09 -2.037712313398272e-09 ] [ -1.582531211728737e-09 2.204506910506656e-10 1.89340762973372e-09 ] [ -6.956492272028142e-10 -1.135679505875416e-09 1.637162710797762e-09 ] [ 5.110413099890515e-10 -2.351941926852927e-09 -3.014833371302189e-10 ] [ 2.810584370894039e-09 -7.887851961288768e-10 4.041267823417709e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 142.72999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.286786530650178e-17 } }