{ "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" [ 5.46847 0 0 ] "si-unit" "m" "si-value" [ 5.46847e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0752926 5.44594 0 ] "si-unit" "m" "si-value" [ 7.52926e-12 5.44594e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00412544 0.201844 5.40303 ] "si-unit" "m" "si-value" [ 4.12544e-13 2.01844e-11 5.40303e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00347607 -0.00350605 -0.096896 ] [ 1.33363 1.43287 1.45525 ] [ -0.0378093 2.6958 2.61111 ] [ 1.37012 4.12622 4.01894 ] [ 2.67267 0.0858706 2.76525 ] [ 3.9434 1.3374 3.96298 ] [ 2.74102 2.68949 -0.0467586 ] [ 4.13757 3.9786 1.32692 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.47607e-13 -3.50605e-13 -9.6896e-12 ] [ 1.33363e-10 1.43287e-10 1.45525e-10 ] [ -3.78093e-12 2.6958e-10 2.61111e-10 ] [ 1.37012e-10 4.12622e-10 4.01894e-10 ] [ 2.67267e-10 8.58706e-12 2.76525e-10 ] [ 3.9434e-10 1.3374e-10 3.96298e-10 ] [ 2.74102e-10 2.68949e-10 -4.67586e-12 ] [ 4.137570000000001e-10 3.9786e-10 1.32692e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6734043999999999 -1.5054597999999997 1.9985388999999998 ] [ 0.6506367999999999 -1.6898809999999997 -3.6367574999999994 ] [ -0.3757886999999999 0.6183574999999999 2.9923797999999997 ] [ -0.7407825999999998 0.9140836999999999 -0.42118039999999995 ] [ -0.7079375999999998 -3.2502528999999996 -2.6429931999999994 ] [ 2.8907952999999997 3.3112585999999995 1.9247711999999997 ] [ -0.35843929999999996 -1.5785295999999998 0.8705401999999999 ] [ -0.6850792999999998 3.1804233999999996 -1.0852988999999997 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.078912786023851e-09 -2.412012495114243e-09 3.202012301339349e-09 ] [ 1.042435069592125e-09 -2.707487830134125e-09 -5.826727842019055e-09 ] [ -6.020798695008248e-10 9.907179297963359e-10 4.794320956114179e-09 ] [ -1.186864562815438e-09 1.464523533594361e-09 -6.748053900191923e-10 ] [ -1.134241071705262e-09 -5.2074792080674e-09 -4.234541913973378e-09 ] [ 4.631564645178522e-09 5.305221114342938e-09 3.08382341702916e-09 ] [ -5.742830664359174e-10 -2.529083220360776e-09 1.394759155906556e-09 ] [ -1.097618037854029e-09 5.095600015725247e-09 -1.738840524159957e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.593092 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.702641986438351e-18 } }