{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.401030000000001e-10 0.0 0.0 ] "source-value" [ 5.40103 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.34454e-11 5.44836e-10 0.0 ] "source-value" [ -0.134454 5.44836 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.22267e-11 -1.77468e-11 5.335340000000001e-10 ] "source-value" [ -0.122267 -0.177468 5.33534 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.958776255475977e-09 4.014865715101208e-09 4.650922783981676e-09 ] [ -3.271988006123438e-09 -2.321040265714571e-09 2.827718368112198e-10 ] [ 8.349366947793313e-10 -3.238439388989858e-09 4.731509544307661e-10 ] [ 1.766402287914593e-09 -1.465651786370728e-09 -8.164054393301722e-10 ] [ -2.356937833991906e-09 1.135786691491348e-09 1.482902582264544e-10 ] [ -6.241745259723053e-10 3.19053286606898e-09 -1.312055119176184e-09 ] [ 1.86413938766027e-09 6.70174458714432e-10 -1.787613023544378e-09 ] [ -1.171154259742522e-09 -1.986228290300809e-09 -1.639062411617044e-09 ] ] "source-value" [ [ 1.8467229000000005 2.5058821000000004 2.9028777000000003 ] [ -2.0422143000000004 -1.4486794000000003 0.17649230000000002 ] [ 0.5211265000000002 -2.0212749000000003 0.29531760000000007 ] [ 1.1025016000000003 -0.9147879000000002 -0.5095602000000001 ] [ -1.4710849000000001 0.7089023000000001 0.09255550000000001 ] [ -0.3895791000000001 1.9913740000000004 -0.8189204000000002 ] [ 1.1635043000000003 0.4182900000000001 -1.1157403000000001 ] [ -0.7309770000000001 -1.2397062000000003 -1.0230223000000003 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.2652e-11 -1.01854e-11 -4.28595e-12 ] [ 1.30252e-10 1.39257e-10 1.42794e-10 ] [ -1.34723e-11 2.79807e-10 2.80389e-10 ] [ 1.19895e-10 4.084240000000001e-10 4.16214e-10 ] [ 2.70678e-10 2.24968e-12 2.81634e-10 ] [ 3.95472e-10 1.30925e-10 4.227070000000001e-10 ] [ 2.581e-10 2.82078e-10 2.50931e-11 ] [ 3.97059e-10 4.21723e-10 1.58759e-10 ] ] "source-value" [ [ -0.12652 -0.101854 -0.0428595 ] [ 1.30252 1.39257 1.42794 ] [ -0.134723 2.79807 2.80389 ] [ 1.19895 4.08424 4.16214 ] [ 2.70678 0.0224968 2.81634 ] [ 3.95472 1.30925 4.22707 ] [ 2.581 2.82078 0.250931 ] [ 3.97059 4.21723 1.58759 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.781072857903388e-18 "source-value" -36.082619 } }