{ "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" [ [ 0.6023674 -0.6589677 -1.1165858 ] [ -0.4928735 0.1612647 -0.05416 ] [ 1.7697904 2.4695852 -0.8963654 ] [ -2.8741621 1.8173188 -2.2100153 ] [ -1.0621914 0.3964 1.9686157 ] [ -1.3834815 -1.2247034 1.9620902 ] [ 0.9856087 -2.5428936 0.1698512 ] [ 2.4549421 -0.418004 0.1765694 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.650989654120819e-10 -1.055782642802348e-09 -1.788967663877265e-09 ] [ -7.896703987118689e-10 2.583745321003258e-10 -8.6773885782528e-11 ] [ 2.83551680259628e-09 3.956711670513692e-09 -1.43613568757404e-09 ] [ -4.604915321009431e-09 2.911665693900311e-09 -3.540834845270298e-09 ] [ -1.701818227894821e-09 6.3510281248512e-10 3.154070049879826e-09 ] [ -2.216581714609315e-09 -1.962191154894271e-09 3.143615046340796e-09 ] [ 1.579119216397081e-09 -4.074164675101947e-09 2.72131621654825e-10 ] [ 3.933250838037656e-09 -6.697162362008832e-10 2.828953646286835e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.905682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.752724425427938e-18 } }