{ "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" [ 5.39198 0 0 ] "si-unit" "m" "si-value" [ 5.39198e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0815956 5.53401 0 ] "si-unit" "m" "si-value" [ 8.15956e-12 5.534010000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.109849 -0.0410552 5.55668 ] "si-unit" "m" "si-value" [ -1.09849e-11 -4.10552e-12 5.55668e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0600222 -0.0188866 -0.0475744 ] [ 1.35953 1.30974 1.45574 ] [ -0.0201429 2.70129 2.75612 ] [ 1.43727 3.87805 4.08993 ] [ 2.67575 -0.0837777 2.76281 ] [ 3.98871 1.3119 4.2787 ] [ 2.73779 2.77507 0.256836 ] [ 4.26747 4.05038 1.42682 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.00222e-12 -1.88866e-12 -4.75744e-12 ] [ 1.35953e-10 1.30974e-10 1.45574e-10 ] [ -2.01429e-12 2.70129e-10 2.75612e-10 ] [ 1.43727e-10 3.87805e-10 4.08993e-10 ] [ 2.67575e-10 -8.37777e-12 2.76281e-10 ] [ 3.98871e-10 1.3119e-10 4.2787e-10 ] [ 2.73779e-10 2.77507e-10 2.56836e-11 ] [ 4.26747e-10 4.05038e-10 1.42682e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.1575569000000008 -1.8897485000000005 0.9681332000000002 ] [ -0.7780009000000002 -0.18621480000000004 -0.5778855000000002 ] [ 1.1279336000000002 -2.3906954000000002 1.7814528000000005 ] [ -0.5192119000000001 2.3912465000000003 0.9524066000000002 ] [ 0.6997862000000001 -0.7175649000000001 0.9682642000000002 ] [ -1.6380703000000005 1.5184526000000005 -1.6119170000000005 ] [ 0.23197660000000006 -1.1081112000000002 -1.8031278000000004 ] [ -2.2819701000000006 2.3826356000000004 -0.6773265000000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.058963844025725e-09 -3.02771086589187e-09 1.551120378860291e-09 ] [ -1.246494852941359e-09 -2.98348999006948e-10 -9.258746375993186e-10 ] [ 1.807148843734779e-09 -3.830316277334105e-09 2.854202027218699e-09 ] [ -8.318691674211476e-10 3.831199236869827e-09 1.525923588015618e-09 ] [ 1.121181089198473e-09 -1.14966570668669e-09 1.551330263997616e-09 ] [ -2.624477937886843e-09 2.432829255512975e-09 -2.582575732070074e-09 ] [ 3.716674850926734e-10 -1.775389857886633e-09 -2.888929205474539e-09 ] [ -3.656119143584639e-09 3.817403054205781e-09 -1.085196682948292e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.698333 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.719503453413312e-18 } }