{ "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" [ [ 7.9620286 -22.4043622 4.2024493 ] [ 5.4617408 12.1688031 4.3101719 ] [ 14.8868782 -14.3465695 16.7015448 ] [ -49.8816875 44.1598773 -42.9538699 ] [ -2.8408366 -4.9352587 4.425589 ] [ -12.0850126 16.9907008 -12.3483559 ] [ 51.3912354 -43.9121671 43.508247 ] [ -14.8943463 12.2789764 -17.8457763 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.275657607706096e-08 -3.589574532077526e-08 6.733066018557325e-09 ] [ 8.750673418629489e-09 1.949657182993856e-08 6.905656649809115e-09 ] [ 2.385140820873719e-08 -2.298573824158234e-08 2.675882460980381e-08 ] [ -7.99192735185516e-08 7.075192298745663e-08 -6.881968612666485e-08 ] [ -4.551521984032961e-09 -7.907156106739801e-09 7.090575229069652e-09 ] [ -1.936232464979342e-08 2.722210359276785e-08 -1.978424712829774e-08 ] [ 8.233783587190934e-08 -7.035504749628294e-08 6.970789615539173e-08 ] [ -2.386337342395899e-08 1.967308891543495e-08 -2.859208556788673e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -23.376739 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.745366469634357e-18 } }