{ "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" [ 5.29616 0 0 ] "si-unit" "m" "si-value" [ 5.29616e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.242438 5.47618 0 ] "si-unit" "m" "si-value" [ -2.42438e-11 5.47618e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.11809 -0.0034447 5.45685 ] "si-unit" "m" "si-value" [ 1.1809e-11 -3.4447e-13 5.456850000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0183909 -0.0832388 -0.0590634 ] [ 1.37993 1.35458 1.33752 ] [ -0.123201 2.75975 2.68859 ] [ 1.45379 4.06883 4.12913 ] [ 2.80695 0.0674874 2.75473 ] [ 4.11558 1.36445 4.01895 ] [ 2.83757 2.84317 -0.0421665 ] [ 3.94058 4.22423 1.31424 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.83909e-12 -8.32388e-12 -5.90634e-12 ] [ 1.37993e-10 1.35458e-10 1.33752e-10 ] [ -1.23201e-11 2.75975e-10 2.68859e-10 ] [ 1.45379e-10 4.06883e-10 4.12913e-10 ] [ 2.80695e-10 6.748740000000001e-12 2.75473e-10 ] [ 4.11558e-10 1.36445e-10 4.01895e-10 ] [ 2.83757e-10 2.84317e-10 -4.21665e-12 ] [ 3.94058e-10 4.224230000000001e-10 1.31424e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3405131 0.2597917 -0.266312 ] [ -0.0110273 0.1292378 -0.0635263 ] [ 0.3295677 0.1559173 -0.1646901 ] [ -0.1538559 -0.2020291 -0.0270497 ] [ -0.2945932 0.0151714 -0.1871297 ] [ 0.0936983 -0.0925917 0.2293364 ] [ -0.2234316 -0.2582841 0.0668029 ] [ -0.080871 -0.0072134 0.4125686 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.455621278961326e-10 4.162321880178874e-10 -4.266788602384896e-10 ] [ -1.766768225054784e-11 2.070617816836263e-10 -1.01780352665927e-10 ] [ 5.280256639108281e-10 2.498070528382599e-10 -2.638626278972141e-10 ] [ -2.465043259521427e-10 -3.236863007412653e-10 -4.333839693965376e-11 ] [ -4.719903376866585e-10 2.430726238480512e-11 -2.998148303973178e-10 ] [ 1.501212256687046e-10 -1.483482570201274e-10 3.674374183784371e-10 ] [ -3.579768858679373e-10 -4.138167465443693e-10 1.070300445816403e-10 ] [ -1.295696255007168e-10 -1.155714083647872e-11 6.610077653961869e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 31.143871 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.989798199741112e-18 } }