{ "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" [ 5.3952 0 0 ] "si-unit" "m" "si-value" [ 5.3952e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00461172 5.6034 0 ] "si-unit" "m" "si-value" [ 4.61172e-13 5.6034e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.071329 0.0469434 5.27588 ] "si-unit" "m" "si-value" [ 7.132900000000001e-12 4.694340000000001e-12 5.27588e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0148313 -0.0405976 0.0741579 ] [ 1.40662 1.33729 1.44565 ] [ 0.021393 2.68696 2.73819 ] [ 1.3197 4.02815 4.06112 ] [ 2.69728 0.0386556 2.72588 ] [ 4.00631 1.34667 3.9586 ] [ 2.7243 2.85873 -0.0805011 ] [ 4.14392 4.06243 1.15826 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.48313e-12 -4.05976e-12 7.41579e-12 ] [ 1.40662e-10 1.33729e-10 1.44565e-10 ] [ 2.1393e-12 2.68696e-10 2.73819e-10 ] [ 1.3197e-10 4.02815e-10 4.06112e-10 ] [ 2.69728e-10 3.86556e-12 2.72588e-10 ] [ 4.00631e-10 1.34667e-10 3.9586e-10 ] [ 2.7243e-10 2.85873e-10 -8.050110000000001e-12 ] [ 4.14392e-10 4.06243e-10 1.15826e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9390908000000002 1.1014594000000002 -1.2649609000000002 ] [ -0.4222063000000001 1.2816169000000002 -2.1990292000000005 ] [ -0.6174253000000001 0.4798871000000001 -1.5844831000000004 ] [ -0.6019460000000001 3.385338200000001 -1.2740266000000002 ] [ 0.34753990000000007 -4.078547000000001 -0.9866259000000002 ] [ 1.2792566000000003 0.26262300000000005 1.5640042000000005 ] [ -0.2587437000000001 -3.419748900000001 1.8371446000000005 ] [ -0.6655660000000001 0.9873713000000002 3.907976800000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.504589324568369e-09 1.764732499440396e-09 -2.026690780206127e-09 ] [ -6.764490630144713e-10 2.053376634002172e-09 -3.523233172696528e-09 ] [ -9.892243807504264e-10 7.688638922435119e-10 -2.538621778872709e-09 ] [ -9.64423808184077e-10 5.423909717541156e-09 -2.041215632797314e-09 ] [ 5.5682030257517e-10 -6.53455265023398e-09 -1.580748950455759e-09 ] [ 2.049595016524098e-09 4.207684306843585e-10 2.505810964073009e-09 ] [ -4.14553106919289e-10 -5.479041736586519e-09 2.943430127148969e-09 ] [ -1.066354284799373e-09 1.581943212908903e-09 6.261269063588799e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.475888 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.683863835571927e-18 } }