{ "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" [ 5.37283 0 0 ] "si-unit" "m" "si-value" [ 5.372830000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.256601 5.36059 0 ] "si-unit" "m" "si-value" [ -2.56601e-11 5.36059e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0433697 -0.246629 5.47376 ] "si-unit" "m" "si-value" [ 4.33697e-12 -2.46629e-11 5.473760000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00270324 -0.00280673 0.144383 ] [ 1.34461 1.35881 1.37149 ] [ -0.0221547 2.59799 2.84643 ] [ 1.34697 4.04373 4.10747 ] [ 2.75027 0.00909757 2.6523 ] [ 4.11164 1.31842 4.20835 ] [ 2.66226 2.78619 -0.017694 ] [ 3.99298 4.09333 1.38778 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.70324e-13 -2.80673e-13 1.44383e-11 ] [ 1.34461e-10 1.35881e-10 1.37149e-10 ] [ -2.21547e-12 2.59799e-10 2.84643e-10 ] [ 1.34697e-10 4.04373e-10 4.10747e-10 ] [ 2.75027e-10 9.09757e-13 2.6523e-10 ] [ 4.11164e-10 1.31842e-10 4.20835e-10 ] [ 2.66226e-10 2.78619e-10 -1.7694e-12 ] [ 3.99298e-10 4.09333e-10 1.38778e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6944159 2.3249567 -3.6655684 ] [ 0.4406277 0.7956 0.3898562 ] [ 0.5550642 1.3925827 -1.2948592 ] [ -0.5629762 -1.0495174 1.1670397 ] [ 0.9679289 0.9437556 0.2196128 ] [ -0.0898124 -2.3766266 -0.0787667 ] [ -1.3611152 0.9591678 0.399681 ] [ -1.6441329 -2.9899189 2.8630047 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.714753540891791e-09 3.724991269112319e-09 -5.872887992423263e-09 ] [ 7.059633994168762e-10 1.27469171950848e-09 6.246184891139289e-10 ] [ 8.893108842830554e-10 2.23116344447054e-09 -2.074593137467792e-09 ] [ -9.019873057068251e-10 -1.681512241402802e-09 1.869803722885446e-09 ] [ 1.550793054176661e-09 1.512063158069077e-09 3.518584937884263e-10 ] [ -1.438953275379379e-10 -3.807775574891393e-09 -1.261981652375673e-10 ] [ -2.180746951655516e-09 1.53675622458417e-09 6.403595539779647e-10 ] [ -2.634191293868104e-09 -4.790378159668054e-09 4.587039195580517e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.103435 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.784407948757245e-18 } }