{ "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" [ 5.49393 0 0 ] "si-unit" "m" "si-value" [ 5.49393e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.002595 5.45604 0 ] "si-unit" "m" "si-value" [ 2.595e-13 5.45604e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0698117 0.0748179 5.57684 ] "si-unit" "m" "si-value" [ -6.981170000000001e-12 7.48179e-12 5.57684e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0568347 0.000259582 0.0366732 ] [ 1.4042 1.34788 1.25876 ] [ -0.0116956 2.70772 2.89683 ] [ 1.4664 4.01047 4.21293 ] [ 2.72042 0.0465962 2.58375 ] [ 4.04434 1.40284 4.02526 ] [ 2.59741 2.72967 0.138309 ] [ 4.11134 4.10597 1.37335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.683470000000001e-12 2.59582e-14 3.66732e-12 ] [ 1.4042e-10 1.34788e-10 1.25876e-10 ] [ -1.16956e-12 2.70772e-10 2.89683e-10 ] [ 1.4664e-10 4.01047e-10 4.21293e-10 ] [ 2.72042e-10 4.65962e-12 2.583750000000001e-10 ] [ 4.04434e-10 1.40284e-10 4.02526e-10 ] [ 2.59741e-10 2.72967e-10 1.38309e-11 ] [ 4.11134e-10 4.10597e-10 1.37335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0650206 1.1910989 -0.2054665 ] [ -1.2886582 -2.3444766 0.6538345 ] [ -0.3353296 2.3928958 -0.8277394 ] [ -0.9862646 -0.2282511 -1.6033256 ] [ 0.6116061 0.7495979 0.9346066 ] [ 0.2704686 -2.227127 0.6466403 ] [ 2.3240914 2.1041858 0.2309655 ] [ 0.4691069 -1.6379238 0.1704845 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.70635112004866e-09 1.908350826363102e-09 -3.29193625369761e-10 ] [ -2.064658057252498e-09 -3.756265627479764e-09 1.047558358403073e-09 ] [ -5.372572498085663e-10 3.833841738356736e-09 -1.326184725721179e-09 ] [ -1.580170097061356e-09 -3.656985791047974e-10 -2.56881081301403e-09 ] [ 9.799010026318674e-10 1.200988240275469e-09 1.497404856502184e-09 ] [ 4.333384711506923e-10 -3.568250840350517e-09 1.03603197926275e-09 ] [ 3.723604936360347e-09 3.371277322354597e-09 3.700475273601269e-10 ] [ 7.515921140281746e-10 -2.624243240632489e-09 2.73146282359173e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -28.682631 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.595464118984405e-18 } }