{ "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" [ 5.47225 0 0 ] "si-unit" "m" "si-value" [ 5.47225e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0720088 5.55574 0 ] "si-unit" "m" "si-value" [ -7.20088e-12 5.55574e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0610026 -0.0268755 5.37267 ] "si-unit" "m" "si-value" [ -6.10026e-12 -2.68755e-12 5.37267e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0205094 -0.0758047 0.142316 ] [ 1.30951 1.38319 1.48801 ] [ -0.0602099 2.69484 2.70363 ] [ 1.30902 4.05591 4.11478 ] [ 2.76224 0.0853385 2.86654 ] [ 4.01949 1.17816 4.04456 ] [ 2.72232 2.71295 0.0698342 ] [ 4.15368 4.12703 1.42088 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.05094e-12 -7.580470000000001e-12 1.42316e-11 ] [ 1.30951e-10 1.38319e-10 1.48801e-10 ] [ -6.02099e-12 2.69484e-10 2.70363e-10 ] [ 1.30902e-10 4.05591e-10 4.11478e-10 ] [ 2.76224e-10 8.53385e-12 2.86654e-10 ] [ 4.01949e-10 1.17816e-10 4.04456e-10 ] [ 2.72232e-10 2.71295e-10 6.983420000000001e-12 ] [ 4.15368e-10 4.127030000000001e-10 1.42088e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5529624000000001 0.17170480000000002 -1.0149216000000003 ] [ 0.8624362000000002 -0.36611430000000006 -0.6843434000000002 ] [ -0.23620450000000007 -0.015556000000000004 1.2059610000000003 ] [ -0.15721620000000003 0.6795737000000001 0.004299500000000001 ] [ -1.7843809000000004 -3.1073071000000008 -2.4609586000000006 ] [ 2.0507586000000004 2.8462199000000004 2.3250874000000006 ] [ 0.3943601000000001 -0.31235240000000003 0.10681250000000003 ] [ -1.6827158000000004 0.10383140000000003 0.5180632000000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.859434294614581e-10 2.751014162391399e-10 -1.62608365946493e-09 ] [ 1.381775116571593e-09 -5.865797720005576e-10 -1.096438996078783e-09 ] [ -3.784413276277538e-10 -2.492345951316481e-11 1.932162519796589e-09 ] [ -2.51888120051017e-10 1.088797094250553e-09 6.888558381129602e-12 ] [ -2.858893360582063e-09 -4.978454789265849e-09 -3.9428903336767e-09 ] [ 3.28567748382454e-09 4.560146981435715e-09 3.725200673596659e-09 ] [ 6.318345323963502e-10 -5.0044371273077e-10 1.711324903092e-10 ] [ -2.69600791421077e-09 1.663562415849332e-10 8.300287471368347e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -22.971259 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.680401412014159e-18 } }