{ "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" [ 5.5048 0 0 ] "si-unit" "m" "si-value" [ 5.5048e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0192448 5.36034 0 ] "si-unit" "m" "si-value" [ 1.92448e-12 5.36034e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.190348 0.0157222 5.58687 ] "si-unit" "m" "si-value" [ 1.90348e-11 1.57222e-12 5.58687e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0113409 -0.0687251 -0.0764128 ] [ 1.39555 1.34846 1.39039 ] [ 0.152538 2.8802 2.74744 ] [ 1.52254 4.15487 3.86439 ] [ 2.76536 0.0171046 2.52424 ] [ 4.13989 1.28016 4.0502 ] [ 2.78466 2.66896 -0.17742 ] [ 4.2307 4.05829 1.13615 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.13409e-12 -6.87251e-12 -7.641280000000001e-12 ] [ 1.39555e-10 1.34846e-10 1.39039e-10 ] [ 1.52538e-11 2.8802e-10 2.74744e-10 ] [ 1.52254e-10 4.15487e-10 3.864390000000001e-10 ] [ 2.76536e-10 1.71046e-12 2.52424e-10 ] [ 4.13989e-10 1.28016e-10 4.0502e-10 ] [ 2.78466e-10 2.66896e-10 -1.7742e-11 ] [ 4.2307e-10 4.058290000000001e-10 1.13615e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1582543 2.3254109 -1.8111803 ] [ -0.8041739 1.1443975 -2.2148791 ] [ -2.1761074 -2.4002218 -1.5999004 ] [ 0.433945 -0.8095165 3.420018 ] [ 2.2359802 0.2937828 0.4558665 ] [ 1.8276475 0.0871521 -0.6085619 ] [ -1.3422717 0.8575639 0.5125052 ] [ -1.3332741 -1.4985689 1.8461319 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.855727975690026e-09 3.72571900842891e-09 -2.90183075662111e-09 ] [ -1.288428632252652e-09 1.833526934508015e-09 -3.548627541154949e-09 ] [ -3.486508429354491e-09 -3.845579284377421e-09 -2.563323037607253e-09 ] [ 6.9525653944113e-10 -1.296988421137461e-09 5.479472927459411e-09 ] [ 3.582435230526647e-09 4.706919376310952e-10 7.30378654523361e-10 ] [ 2.928214119688515e-09 1.396330582240314e-10 -9.750236565226446e-10 ] [ -2.150556354219458e-09 1.373968842741912e-09 8.211238562434966e-10 ] [ -2.136140609737379e-09 -2.400972076019082e-09 2.957829393462025e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.429886 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.676493549448373e-18 } }