{ "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" [ [ -2.1713568 -2.8301304 -1.6067725 ] [ 0.4143004 2.0406716 1.9333085 ] [ -3.7501243 -4.5341704 -5.3077778 ] [ 0.0773574 10.1429613 -1.6650557 ] [ -2.7927048 -4.0030271 -1.2042241 ] [ 0.9012813 3.012452 4.5148882 ] [ 3.6492727 -8.5225106 0.2910015 ] [ 3.6719741 4.6937537 3.044632 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.478897100375101e-09 -4.534368760695351e-09 -2.574333334444368e-09 ] [ 6.637824148680883e-10 3.269516328250529e-09 3.097501679493917e-09 ] [ -6.008361478553966e-09 -7.264541809603384e-09 -8.503997499561259e-09 ] [ 1.239402177258739e-10 1.625081546053917e-08 -2.667713314869778e-09 ] [ -4.47440633935594e-09 -6.413556432048824e-09 -1.929379699223921e-09 ] [ 1.444011827624231e-09 4.826480165682202e-09 7.233648319565794e-09 ] [ 5.846779402863692e-09 -1.365456723384018e-08 4.662357999177312e-10 ] [ 5.883151055203121e-09 7.520222441933498e-09 4.878038209339545e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.113057 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.465514238941778e-18 } }