{ "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" [ [ 0.8672215999999999 0.15092899999999998 2.4077293999999996 ] [ -0.6150136999999999 0.09248699999999999 0.22451389999999996 ] [ 0.4565584999999999 -1.2356189999999998 0.028429599999999996 ] [ 1.4654495999999997 -0.21611199999999997 0.12745549999999997 ] [ -0.7040952999999999 0.8396054999999999 -0.07779439999999999 ] [ -1.5051912999999997 0.8235684999999999 -0.9644360999999999 ] [ -0.13926599999999997 -0.22231509999999996 -0.38575289999999995 ] [ 0.17433639999999997 -0.23254389999999997 -1.3601448999999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.389442172572769e-09 2.418149152007232e-10 3.857607753892811e-09 ] [ -9.853605716117048e-10 1.481805091279296e-10 3.597109216246291e-10 ] [ 7.314873547275167e-10 -1.979679874016275e-09 4.554924045869568e-11 ] [ 2.347909088080711e-09 -3.462495938743295e-10 2.042062222923744e-10 ] [ -1.128085028475162e-09 1.345196302795094e-09 -1.246403689091635e-10 ] [ -2.411582310691558e-09 1.319502196327325e-09 -1.545196971675531e-09 ] [ -2.231287292723327e-10 -3.56188055670814e-10 -6.180442777858003e-10 ] [ 2.793177042344371e-10 -3.725763998896531e-10 -2.179192359680354e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 147.92751 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.370059980951582e-17 } }