{ "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" [ 5.48581 0 0 ] "si-unit" "m" "si-value" [ 5.48581e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00228581 5.44331 0 ] "si-unit" "m" "si-value" [ 2.28581e-13 5.44331e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0206328 -0.0957916 5.42731 ] "si-unit" "m" "si-value" [ -2.06328e-12 -9.57916e-12 5.427310000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00584564 0.00126862 0.0177865 ] [ 1.36937 1.35462 1.37323 ] [ -0.0302415 2.74811 2.64947 ] [ 1.37836 4.07615 4.08107 ] [ 2.65918 -0.0413914 2.54007 ] [ 4.19104 1.29728 4.08084 ] [ 2.79028 2.80414 0.0605432 ] [ 4.08315 4.18517 1.33386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.845640000000001e-13 1.26862e-13 1.77865e-12 ] [ 1.36937e-10 1.35462e-10 1.37323e-10 ] [ -3.02415e-12 2.74811e-10 2.64947e-10 ] [ 1.37836e-10 4.07615e-10 4.081070000000001e-10 ] [ 2.65918e-10 -4.13914e-12 2.54007e-10 ] [ 4.19104e-10 1.29728e-10 4.08084e-10 ] [ 2.79028e-10 2.80414e-10 6.05432e-12 ] [ 4.08315e-10 4.18517e-10 1.33386e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.32566 0.484184 -0.3911669 ] [ -0.3509699 1.3291177 -1.068246 ] [ -0.0495048 -0.1766452 0.5862391 ] [ 0.3370487 -0.2983926 -0.3507049 ] [ -0.6452368 -0.5899473 1.8100778 ] [ -0.1555057 1.3591494 0.4805427 ] [ -0.7669103 -1.1187727 -1.293785 ] [ 1.3054189 -0.9886934 0.2270432 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.217648426284399e-10 7.75748291356656e-10 -6.267184671742145e-10 ] [ -5.623157730173166e-10 2.129481322775822e-09 -1.711518780563964e-09 ] [ -7.93154338308432e-11 -2.830168119482568e-10 9.392585879571894e-10 ] [ 5.400115516600758e-10 -4.780776514785084e-10 -5.618911962093065e-10 ] [ -1.033783324356931e-09 -9.45199779351388e-10 2.900064356882125e-09 ] [ -2.491475989938138e-10 2.177597410795119e-09 7.699142855792717e-10 ] [ -1.22872576303393e-09 -1.792471478697092e-09 -2.07287209641969e-09 ] [ 2.091511659161982e-09 -1.584061463670015e-09 3.637633099485888e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -34.723507 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.563319156593543e-18 } }