{ "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" [ 5.59774 0 0 ] "si-unit" "m" "si-value" [ 5.597740000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.20689 5.51351 0 ] "si-unit" "m" "si-value" [ -2.0689e-11 5.513510000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.513105 0.215809 5.94806 ] "si-unit" "m" "si-value" [ 5.131050000000001e-11 2.15809e-11 5.94806e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00246673 -0.00144352 -0.0330248 ] [ 1.48237 1.24989 1.2555 ] [ 0.11896 2.3805 2.33914 ] [ 1.62926 4.22989 4.16904 ] [ 2.92639 0.137476 2.28463 ] [ 4.54625 1.57381 3.68026 ] [ 3.00188 2.71108 0.0736878 ] [ 4.22934 4.27512 1.23802 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.46673e-13 -1.44352e-13 -3.30248e-12 ] [ 1.48237e-10 1.24989e-10 1.2555e-10 ] [ 1.1896e-11 2.3805e-10 2.33914e-10 ] [ 1.62926e-10 4.22989e-10 4.16904e-10 ] [ 2.92639e-10 1.37476e-11 2.28463e-10 ] [ 4.54625e-10 1.57381e-10 3.68026e-10 ] [ 3.00188e-10 2.71108e-10 7.36878e-12 ] [ 4.22934e-10 4.27512e-10 1.23802e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.7365575 -2.4966506 -4.5676195 ] [ -0.2775811 0.246815 -2.3077291 ] [ -1.1182397 4.9917342 -1.7041154 ] [ -0.9686246 4.8924561 0.5651047 ] [ 1.1785228 -1.5356144 6.9075406 ] [ -4.2774486 -1.9769538 2.846527 ] [ 0.6608405 -1.3519458 -4.4116505 ] [ 1.0659732 -2.7698407 2.6719421 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.986625118097454e-09 -4.00007525458208e-09 -7.318133235902763e-09 ] [ -4.447339524600173e-10 3.954412259207099e-10 -3.697389641621849e-09 ] [ -1.79161751855117e-09 7.997639898378682e-09 -2.730293875519563e-09 ] [ -1.551907701237596e-09 7.838578846290767e-09 9.053975461035797e-10 ] [ 1.888201692796255e-09 -2.460325510513929e-09 1.106710014772634e-08 ] [ -6.853228200056011e-09 -3.167429184857509e-09 4.560639047450118e-09 ] [ 1.058783207900877e-09 -2.166055971194437e-09 -7.068243348474417e-09 ] [ 1.707877353510208e-09 -4.437774049442204e-09 4.28092320002089e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.877638 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.146054694671049e-18 } }