{ "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" [ [ -5.7655156 -4.0171498 -1.8852706 ] [ 9.6008024 -4.5176205 -3.9675239 ] [ -2.9432474 11.740063 5.9310022 ] [ 0.1091201 -1.7905066000000003 -6.0812565 ] [ -18.5325312 26.9071373 20.3861602 ] [ -6.780673 -5.2637653 3.6264009 ] [ 5.0601787 -0.13584390000000002 -1.949703 ] [ 19.251866 -22.9223142 -16.0598093 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.237374377282489e-09 -6.436183544837773e-09 -3.02053650408716e-09 ] [ 1.538218127293112e-08 -7.238026006379396e-09 -6.356674087416553e-09 ] [ -4.715602212361252e-09 1.880965462028794e-08 9.502513141042594e-09 ] [ 1.748296745197434e-10 -2.868707837542785e-09 -9.743247069660621e-09 ] [ -2.969238845751598e-08 4.310998666988984e-08 3.266222952942076e-08 ] [ -1.086383584339468e-08 -8.43348177052e-09 5.81013478749657e-09 ] [ 8.107300077004494e-09 -2.176459224514326e-10 -3.123768589839702e-09 ] [ 3.084488986609904e-08 -3.67255962084464e-08 -2.57306512069559e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -24.209744 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.878828615192169e-18 } }