{ "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" [ 5.3952 0 0 ] "si-unit" "m" "si-value" [ 5.3952e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00461172 5.6034 0 ] "si-unit" "m" "si-value" [ 4.61172e-13 5.6034e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.071329 0.0469434 5.27588 ] "si-unit" "m" "si-value" [ 7.132900000000001e-12 4.694340000000001e-12 5.27588e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0148313 -0.0405976 0.0741579 ] [ 1.40662 1.33729 1.44565 ] [ 0.021393 2.68696 2.73819 ] [ 1.3197 4.02815 4.06112 ] [ 2.69728 0.0386556 2.72588 ] [ 4.00631 1.34667 3.9586 ] [ 2.7243 2.85873 -0.0805011 ] [ 4.14392 4.06243 1.15826 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.48313e-12 -4.05976e-12 7.41579e-12 ] [ 1.40662e-10 1.33729e-10 1.44565e-10 ] [ 2.1393e-12 2.68696e-10 2.73819e-10 ] [ 1.3197e-10 4.02815e-10 4.06112e-10 ] [ 2.69728e-10 3.86556e-12 2.72588e-10 ] [ 4.00631e-10 1.34667e-10 3.9586e-10 ] [ 2.7243e-10 2.85873e-10 -8.050110000000001e-12 ] [ 4.14392e-10 4.06243e-10 1.15826e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6647454000000002 0.6328763000000001 -0.7268696000000001 ] [ -0.30332640000000005 0.9561050000000002 -1.5764840000000004 ] [ -0.22434900000000005 0.24675470000000005 -1.3150143000000003 ] [ 0.5741284000000001 2.3756009000000002 -1.7921093000000003 ] [ 0.24805270000000004 -2.9999727000000003 -0.7491476000000001 ] [ 0.9500713000000002 0.18312000000000003 1.1292973000000002 ] [ -0.45058930000000014 -2.2439266000000004 1.4340111000000002 ] [ -1.4587331000000001 0.8494424000000003 3.596316500000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.065039538664345e-09 1.013979611718407e-09 -1.164573479490248e-09 ] [ -4.859824665514292e-10 1.531849078029984e-09 -2.525805807865268e-09 ] [ -3.594467226998593e-10 3.953446114125179e-10 -2.106885167477678e-09 ] [ 9.198550998173109e-10 3.806132222331439e-09 -2.871275622378254e-09 ] [ 3.974242366663162e-10 -4.806486122978252e-09 -1.20026677024843e-09 ] [ 1.522182024953063e-09 2.933905828008961e-10 1.809333731992564e-09 ] [ -7.219236420426377e-10 -3.595166737311234e-09 2.297539058387691e-09 ] [ -2.337148068807109e-09 1.360956753996243e-09 5.761934217297285e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -40.874461 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.548810580200139e-18 } }