{ "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" [ 5.46879 0 0 ] "si-unit" "m" "si-value" [ 5.468790000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.164352 5.45396 0 ] "si-unit" "m" "si-value" [ -1.64352e-11 5.453960000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.164037 0.0480481 5.25114 ] "si-unit" "m" "si-value" [ -1.64037e-11 4.804810000000001e-12 5.251140000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.110213 -0.12035 -0.0596546 ] [ 1.31419 1.39201 1.41434 ] [ -0.168287 2.6382 2.797 ] [ 1.3034 4.08885 4.02601 ] [ 2.55869 -0.0573607 2.7167 ] [ 3.95328 1.36182 4.12861 ] [ 2.72846 2.73806 0.151815 ] [ 4.07331 4.0714 1.3741 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.10213e-11 -1.2035e-11 -5.96546e-12 ] [ 1.31419e-10 1.39201e-10 1.41434e-10 ] [ -1.68287e-11 2.6382e-10 2.797e-10 ] [ 1.3034e-10 4.08885e-10 4.02601e-10 ] [ 2.55869e-10 -5.736070000000001e-12 2.7167e-10 ] [ 3.95328e-10 1.36182e-10 4.12861e-10 ] [ 2.72846e-10 2.73806e-10 1.51815e-11 ] [ 4.07331e-10 4.0714e-10 1.3741e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.067150900000001 0.25325230000000004 1.0595644000000002 ] [ -1.1570371000000002 -0.7580851000000002 -0.4601728000000001 ] [ 1.0041808000000003 0.7475134000000001 -0.5652803000000001 ] [ -2.6340734000000006 -0.8026024000000003 0.8180312000000002 ] [ 2.6290841000000005 1.0190284000000003 -1.0453394000000003 ] [ -1.6738979000000005 0.28996570000000005 -1.2103716000000002 ] [ 0.14631730000000004 -0.7718098000000002 -0.28272980000000003 ] [ -1.3817247000000001 0.0227374 1.6862983000000005 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.914117464445681e-09 4.057549142238279e-10 1.69760930991198e-09 ] [ -1.853777791018232e-09 -1.21458622379683e-09 -7.372781016880744e-10 ] [ 1.608875000816241e-09 1.197648493214719e-09 -9.056788808588103e-10 ] [ -4.220250818951167e-09 -1.28591080107797e-09 1.310630463724969e-09 ] [ 4.21225707913701e-09 1.632663478411231e-09 -1.6748183474811e-09 ] [ -2.681880080986217e-09 4.645762653739066e-10 -1.93922908000029e-09 ] [ 2.344261572785799e-10 -1.236575617264324e-09 -4.529830755634599e-10 ] [ -2.213767010721894e-09 3.642933069777792e-11 2.701747711954786e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.748357 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.125341560941203e-18 } }