{ "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" [ 5.4419 0 0 ] "si-unit" "m" "si-value" [ 5.441900000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.361794 5.44502 0 ] "si-unit" "m" "si-value" [ 3.61794e-11 5.44502e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0366443 0.298499 5.53333 ] "si-unit" "m" "si-value" [ 3.66443e-12 2.98499e-11 5.53333e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.128377 -0.150066 -0.170326 ] [ 1.39649 1.37402 1.31098 ] [ -0.0542726 2.97617 3.14736 ] [ 1.41657 4.24499 4.02908 ] [ 2.7363 -0.234712 2.6251 ] [ 4.24505 1.08558 3.99518 ] [ 2.94651 2.56191 -0.00354123 ] [ 4.33312 3.8007 1.43779 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.28377e-11 -1.50066e-11 -1.70326e-11 ] [ 1.39649e-10 1.37402e-10 1.31098e-10 ] [ -5.42726e-12 2.97617e-10 3.14736e-10 ] [ 1.41657e-10 4.24499e-10 4.02908e-10 ] [ 2.7363e-10 -2.34712e-11 2.6251e-10 ] [ 4.24505e-10 1.08558e-10 3.99518e-10 ] [ 2.94651e-10 2.56191e-10 -3.54123e-13 ] [ 4.33312e-10 3.8007e-10 1.43779e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 14.236519499999998 -12.099615099999998 24.277376399999998 ] [ -2.5921861999999996 -1.9193330999999998 1.2170284999999998 ] [ -2.2557145999999997 -12.751911499999999 -1.9867583999999998 ] [ 12.298514699999998 2.6277419999999996 4.933218899999999 ] [ -3.8057223999999996 5.233932199999999 3.0946838999999997 ] [ -18.172083799999996 15.814320799999999 -17.094891499999996 ] [ -0.34830799999999995 -0.6470917999999999 -3.9152847999999993 ] [ 0.6389806999999998 3.7419565999999995 -10.525372999999998 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.280941889238536e-08 -1.938572059361357e-08 3.889664520290303e-08 ] [ -4.153140160617249e-09 -3.075110645682785e-09 1.949894625612069e-09 ] [ -3.614053225092656e-09 -2.043081464413589e-08 -3.183137885883225e-09 ] [ 1.970439288524552e-08 4.210106832580427e-09 7.90388805198718e-09 ] [ -6.0974395047704e-09 8.385683874780213e-09 4.958230234195992e-09 ] [ -2.911488805544992e-08 2.533733526834018e-08 -2.73890357220652e-08 ] [ -5.58050939035272e-10 -1.036755362013001e-09 -6.272977822015362e-09 ] [ 1.023759947116963e-09 5.995275429962083e-09 -1.686350668473448e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -26.637294 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.267765003978839e-18 } }