{ "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" [ 5.46441 0 0 ] "si-unit" "m" "si-value" [ 5.46441e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.239301 5.60761 0 ] "si-unit" "m" "si-value" [ 2.39301e-11 5.60761e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.167861 -0.733416 5.71653 ] "si-unit" "m" "si-value" [ 1.67861e-11 -7.33416e-11 5.71653e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00327702 -0.0382766 0.433443 ] [ 1.09616 1.45225 1.46895 ] [ 0.130178 2.57242 2.88603 ] [ 1.56489 3.87283 4.50025 ] [ 2.74098 -0.214768 2.33093 ] [ 4.21449 1.24218 3.87733 ] [ 2.20243 2.94328 0.228142 ] [ 4.00805 4.02926 1.38377 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.27702e-13 -3.82766e-12 4.33443e-11 ] [ 1.09616e-10 1.45225e-10 1.46895e-10 ] [ 1.30178e-11 2.57242e-10 2.88603e-10 ] [ 1.56489e-10 3.87283e-10 4.500250000000001e-10 ] [ 2.74098e-10 -2.14768e-11 2.33093e-10 ] [ 4.21449e-10 1.24218e-10 3.87733e-10 ] [ 2.20243e-10 2.94328e-10 2.28142e-11 ] [ 4.00805e-10 4.02926e-10 1.38377e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.2251071 1.6908877 1.4496479 ] [ -4.3168134 2.2224583 1.5032629 ] [ 1.4774191 -4.8676209 -2.4296819 ] [ -0.5334205 -0.30621899999999996 2.9432883 ] [ 5.1647619 -4.7362699 -5.8680115 ] [ 3.1516221 0.9321969999999999 -3.2762197 ] [ -3.166856 -0.12922409999999995 2.4487306 ] [ -4.0018203 5.1937908 3.2289834 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.5650146037675e-09 2.709100763658002e-09 2.322591992907168e-09 ] [ -6.916297562818095e-09 3.560770758299362e-09 2.408492693139078e-09 ] [ 2.367086360645309e-09 -7.79878846915005e-09 -3.892779568232724e-09 ] [ -8.546338611965969e-10 -4.906169266868459e-10 4.715667741385581e-09 ] [ 8.274860836353445e-09 -7.588340966097516e-09 -9.401590913343291e-09 ] [ 5.049455287818012e-09 1.493544251684898e-09 -5.249082651190489e-09 ] [ -5.073862686442703e-09 -2.070398335696793e-10 3.9232989502808e-09 ] [ -6.41162297812687e-09 8.321370261644167e-09 5.173401755053875e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 5.318412398437523 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.521036074752497e-19 } }