{ "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" [ 5.40884 0 0 ] "si-unit" "m" "si-value" [ 5.40884e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0760511 5.4684 0 ] "si-unit" "m" "si-value" [ 7.60511e-12 5.4684e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0640574 0.226818 5.41063 ] "si-unit" "m" "si-value" [ 6.40574e-12 2.26818e-11 5.41063e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00830896 0.0131794 0.144184 ] [ 1.38941 1.30499 1.31845 ] [ 0.000666759 2.66681 2.72971 ] [ 1.38566 4.09949 4.22322 ] [ 2.74889 -0.0321093 2.66684 ] [ 4.05308 1.21875 4.179 ] [ 2.6535 2.74282 -0.0977168 ] [ 4.21539 3.9917 1.44444 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.308960000000001e-13 1.31794e-12 1.44184e-11 ] [ 1.38941e-10 1.30499e-10 1.31845e-10 ] [ 6.667589999999999e-14 2.66681e-10 2.72971e-10 ] [ 1.38566e-10 4.099490000000001e-10 4.223220000000001e-10 ] [ 2.74889e-10 -3.21093e-12 2.66684e-10 ] [ 4.05308e-10 1.21875e-10 4.179e-10 ] [ 2.6535e-10 2.74282e-10 -9.771680000000001e-12 ] [ 4.21539e-10 3.9917e-10 1.44444e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7925497 -4.420399 -0.4706009 ] [ 0.0544388 2.0004087 1.1763443 ] [ 2.0025832 -1.3413869 2.3624408 ] [ -2.40855 3.5170919 -4.915475 ] [ -0.7165829 -1.5916744 2.0215853 ] [ -0.9378216 4.5221094 -2.5807439 ] [ 4.195614 -4.2184432 4.5561909 ] [ -2.9822312 1.5322935 -2.1497415 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.269804600162054e-09 -7.082259932407698e-09 -7.539857597074387e-10 ] [ 8.722057262440705e-11 3.205008051184921e-09 1.884711335471342e-09 ] [ 3.208491984246851e-09 -2.149138730627388e-09 3.785047417784049e-09 ] [ -3.85892250002784e-09 5.635002415385052e-09 -7.87545912512688e-09 ] [ -1.148092369245064e-09 -2.550143511605868e-09 3.238936704612954e-09 ] [ -1.502555842001249e-09 7.245217957379915e-09 -4.134807540852213e-09 ] [ 6.722114660701171e-09 -6.758691071212739e-09 7.299822539881711e-09 ] [ -4.778061106460329e-09 2.455004821903805e-09 -3.444265572063524e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.59085 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.542065116359969e-18 } }