{ "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" [ 5.46879 0 0 ] "si-unit" "m" "si-value" [ 5.468790000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.164352 5.45396 0 ] "si-unit" "m" "si-value" [ -1.64352e-11 5.453960000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.164037 0.0480481 5.25114 ] "si-unit" "m" "si-value" [ -1.64037e-11 4.804810000000001e-12 5.251140000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.110213 -0.12035 -0.0596546 ] [ 1.31419 1.39201 1.41434 ] [ -0.168287 2.6382 2.797 ] [ 1.3034 4.08885 4.02601 ] [ 2.55869 -0.0573607 2.7167 ] [ 3.95328 1.36182 4.12861 ] [ 2.72846 2.73806 0.151815 ] [ 4.07331 4.0714 1.3741 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.10213e-11 -1.2035e-11 -5.96546e-12 ] [ 1.31419e-10 1.39201e-10 1.41434e-10 ] [ -1.68287e-11 2.6382e-10 2.797e-10 ] [ 1.3034e-10 4.08885e-10 4.02601e-10 ] [ 2.55869e-10 -5.736070000000001e-12 2.7167e-10 ] [ 3.95328e-10 1.36182e-10 4.12861e-10 ] [ 2.72846e-10 2.73806e-10 1.51815e-11 ] [ 4.07331e-10 4.0714e-10 1.3741e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.403529100000001 0.11194720000000002 1.5694315000000005 ] [ -1.7979761000000005 -1.0951196000000003 -0.7134796000000001 ] [ 1.4101771000000003 1.0769609000000002 -0.7739252000000002 ] [ -3.734692400000001 -1.0608127000000003 1.1333767000000001 ] [ 3.897203800000001 1.3500927000000003 -1.6734225000000005 ] [ -2.4538069000000005 0.5192300000000001 -1.8932959000000005 ] [ 0.23879950000000005 -1.1037401000000002 -0.30793020000000004 ] [ -1.9632340000000004 0.20144160000000005 2.6592452000000004 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.055231373032467e-09 1.793591866040218e-10 2.514506457247076e-09 ] [ -2.880675272177164e-09 -1.754575020099848e-09 -1.143120334537736e-09 ] [ 2.259352780807544e-09 1.725481575495727e-09 -1.239964861687964e-09 ] [ -5.983636849159444e-09 -1.699609306987725e-09 1.815869651299456e-09 ] [ 6.244008814852921e-09 2.163086959852749e-09 -2.681118406220689e-09 ] [ -3.931432047137724e-09 8.318981668179842e-10 -3.033394427236496e-09 ] [ 3.825989759587297e-10 -1.768386583659455e-09 -4.933585672782683e-10 ] [ -3.145447615959668e-09 3.227450219765454e-10 4.26058048841462e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.583571 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.701116554077688e-18 } }