{ "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" [ 5.4726 0 0 ] "si-unit" "m" "si-value" [ 5.4726e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.038105 5.56078 0 ] "si-unit" "m" "si-value" [ 3.8105e-12 5.560780000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0300683 -0.0732695 5.55519 ] "si-unit" "m" "si-value" [ -3.00683e-12 -7.32695e-12 5.55519e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0119551 0.065874 -0.0174062 ] [ 1.35048 1.36142 1.35358 ] [ 0.0629681 2.82177 2.8468 ] [ 1.33242 4.00392 4.21267 ] [ 2.75302 -0.0155517 2.72 ] [ 4.0777 1.32793 4.00537 ] [ 2.56601 2.8685 0.00815077 ] [ 4.04738 3.99965 1.27482 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.19551e-12 6.587400000000001e-12 -1.74062e-12 ] [ 1.35048e-10 1.36142e-10 1.35358e-10 ] [ 6.296810000000001e-12 2.82177e-10 2.8468e-10 ] [ 1.33242e-10 4.00392e-10 4.21267e-10 ] [ 2.75302e-10 -1.55517e-12 2.72e-10 ] [ 4.0777e-10 1.32793e-10 4.00537e-10 ] [ 2.56601e-10 2.8685e-10 8.15077e-13 ] [ 4.047380000000001e-10 3.99965e-10 1.27482e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1219966 -1.2580745 -0.5490409 ] [ 0.132812 0.614481 0.8955358 ] [ -1.4201389 -1.4406507 -1.881396 ] [ 0.2442972 3.2242427 -0.5747513 ] [ -0.7622371 -1.5895785 -0.373092 ] [ 0.1385606 1.0222931 1.6760636 ] [ 1.4861234 -2.5235313 -0.332006 ] [ 1.3025794 1.9508183 1.138687 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.797636721137089e-09 -2.01565755112465e-09 -8.796604938429908e-10 ] [ 2.127882813616896e-10 9.84507092125805e-10 1.434806521849425e-09 ] [ -2.275313343868629e-09 -2.308176870279155e-09 -3.014328685666637e-09 ] [ 3.914072623669018e-10 5.165806273725068e-09 -9.20853095634407e-10 ] [ -1.221238461126392e-09 -2.546785509626333e-09 -5.977592798075135e-10 ] [ 2.219985538840205e-10 1.637894104425156e-09 2.685349914893883e-09 ] [ 2.381032167103807e-09 -4.043142850717031e-09 -5.319322511653248e-10 ] [ 2.086962261415692e-09 3.1255554716888e-09 1.82437768980889e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.922772038775914 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.711326971965472e-18 } }