{ "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" [ [ 0.5235952 -0.7448073 -1.2457521 ] [ -0.2977067 0.2213242 -0.0854077 ] [ 1.7232413 2.8199965 -0.8083425 ] [ -2.9413169 1.7430397 -2.3228978 ] [ -1.1482567 0.3247935 2.0255436 ] [ -1.456567 -1.1404291 2.0626987 ] [ 1.0101008 -2.6420774 0.0639085 ] [ 2.58691 -0.58184 0.3102491 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.388919882031002e-10 -1.193312843061172e-09 -1.995914889932504e-09 ] [ -4.769787145955193e-10 3.546004588572634e-10 -1.368382201763002e-10 ] [ 2.760936922856999e-09 4.518132463037828e-09 -1.295107455099024e-09 ] [ -4.712509171543932e-09 2.792657456466246e-09 -3.721692547667754e-09 ] [ -1.839710039416959e-09 5.203765522878048e-10 3.245278600331068e-09 ] [ -2.333677594028793e-09 -1.827168841699985e-09 3.304807632894553e-09 ] [ 1.618359886411377e-09 -4.23307464062405e-09 1.023927045703968e-10 ] [ 4.144686722113728e-09 -9.32210445046272e-10 4.970738546442412e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.846663 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.743268539229639e-18 } }