{ "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" [ 5.30636 0 0 ] "si-unit" "m" "si-value" [ 5.30636e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0781877 5.44815 0 ] "si-unit" "m" "si-value" [ -7.81877e-12 5.44815e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00200818 -0.0968672 5.44923 ] "si-unit" "m" "si-value" [ -2.00818e-13 -9.686720000000001e-12 5.44923e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0183636 0.00704735 0.0168371 ] [ 1.29138 1.3449 1.40641 ] [ -0.0614737 2.68753 2.83465 ] [ 1.25782 4.05715 4.11756 ] [ 2.70205 0.0250121 2.83894 ] [ 3.96698 1.43423 4.04452 ] [ 2.67871 2.79142 0.0958918 ] [ 4.00247 4.11579 1.29634 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.83636e-12 7.04735e-13 1.68371e-12 ] [ 1.29138e-10 1.3449e-10 1.40641e-10 ] [ -6.14737e-12 2.687530000000001e-10 2.83465e-10 ] [ 1.25782e-10 4.05715e-10 4.117560000000001e-10 ] [ 2.70205e-10 2.50121e-12 2.83894e-10 ] [ 3.96698e-10 1.43423e-10 4.044520000000001e-10 ] [ 2.67871e-10 2.79142e-10 9.589180000000001e-12 ] [ 4.00247e-10 4.11579e-10 1.29634e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6570872000000001 1.8579224000000005 -1.4716389000000003 ] [ 0.6946865000000001 0.3198943000000001 0.7302014000000001 ] [ 1.4485913000000001 1.7056378000000005 -3.214604700000001 ] [ 1.0397772000000003 -0.18903550000000005 1.0240429000000002 ] [ -0.7961349000000002 -0.8895351000000002 -2.4026743000000006 ] [ -0.5245264000000001 -1.9404936000000004 3.4238128000000008 ] [ -1.7771894000000004 -0.6639345000000001 -1.6815108000000005 ] [ -0.7422916000000002 -0.20045580000000005 3.5923716000000008 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.052769758340485e-09 2.976719857065202e-09 -2.357825459265463e-09 ] [ 1.113010478255241e-09 5.125271728097862e-10 1.169911621194088e-09 ] [ 2.320899133075684e-09 2.732733029227166e-09 -5.150364537886581e-09 ] [ 1.665906734405945e-09 -3.028682610965071e-10 1.640697606593599e-09 ] [ -1.275548734291927e-09 -1.425192352342853e-09 -3.849508622572307e-09 ] [ -8.403839419961376e-10 -3.109013504346543e-09 5.485552867350116e-09 ] [ -2.84737133087248e-09 -1.063740342406473e-09 -2.694077313578648e-09 ] [ -1.189282257134474e-09 -3.211655989097772e-10 5.755613838165195e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.018145 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.770743031902392e-18 } }