{ "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" [ [ 3.2650054999999996 -2.3999397999999994 7.488933499999999 ] [ -1.9811376999999997 -0.31701519999999994 0.9683279999999999 ] [ -0.9215158999999999 -3.9102089999999996 -2.6202590999999997 ] [ 3.8799343999999993 0.39774059999999994 2.2438169999999995 ] [ -0.7899138999999998 1.6839614999999997 1.1229391999999998 ] [ -4.056506099999999 3.7218343999999997 -2.2152373999999995 ] [ 0.03591769999999999 -1.0964255999999997 -2.5789980999999997 ] [ 0.5682160999999999 1.9200530999999998 -4.409523199999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.231115478883413e-09 -3.845127438887427e-09 1.199859416842592e-08 ] [ -3.174132505525483e-09 -5.079143418782361e-10 1.551432482866022e-09 ] [ -1.476431230675471e-09 -6.264845442241746e-09 -4.198117870458449e-09 ] [ 6.216340185917675e-09 6.372506904629644e-10 3.594991138753593e-09 ] [ -1.265581583024949e-09 2.698003745627299e-09 1.799146932819855e-09 ] [ -6.499239235552585e-09 5.963036062169195e-09 -3.549201571801777e-09 ] [ 5.754649921290815e-11 -1.756667462766612e-09 -4.13201046090762e-09 ] [ 9.103825509821548e-10 3.076264187514564e-09 -7.0648349799152e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -32.634899 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.22868721999693e-18 } }