{ "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" [ [ 0.9774069000000002 1.0862479000000003 -1.3107867000000002 ] [ -0.7929971000000002 1.0248445000000002 -2.0005368000000003 ] [ -0.4538376000000001 0.4195715000000001 -1.5449494000000004 ] [ -0.6445768000000001 3.312476600000001 -1.5780149000000006 ] [ 0.023443600000000005 -3.2954950000000007 -0.6667271000000001 ] [ 1.3489290000000003 0.3822955000000001 1.6568628000000005 ] [ 0.20454820000000007 -3.402911300000001 1.7749021000000005 ] [ -0.6629162000000001 0.4729703000000001 3.669250100000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.565978484188604e-09 1.740360989773097e-09 -2.100111805595583e-09 ] [ -1.2705214139822e-09 1.641981897855466e-09 -3.205213290010046e-09 ] [ -7.271279923599824e-10 6.722276480539873e-10 -2.475281808998988e-09 ] [ -1.032725879270078e-09 5.307172565467075e-09 -2.528258580054051e-09 ] [ 3.756078782738689e-11 -5.279965042963297e-09 -1.068214572073784e-09 ] [ 2.161222506919124e-09 6.125049123370467e-10 2.654586842033227e-09 ] [ 3.277223438667227e-10 -5.452064927516136e-09 2.843706648828824e-09 ] [ -1.062108837189577e-09 7.577819569927624e-10 5.878786726088064e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.446869 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.679214479236028e-18 } }