{ "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" [ 5.05932 0 0 ] "si-unit" "m" "si-value" [ 5.059319999999999e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.224512 5.44129 0 ] "si-unit" "m" "si-value" [ 2.24512e-11 5.441290000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.327401 0.688972 5.24092 ] "si-unit" "m" "si-value" [ 3.27401e-11 6.88972e-11 5.24092e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.119472 0.0796179 0.152764 ] [ 1.48092 1.5486 0.772169 ] [ 0.0612704 2.84226 2.7863 ] [ 1.84412 4.4971 3.9905 ] [ 2.88701 0.305191 2.51679 ] [ 4.25223 1.88781 3.92663 ] [ 2.58737 2.78734 -0.624797 ] [ 3.988 4.24006 0.48768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.19472e-11 7.96179e-12 1.52764e-11 ] [ 1.48092e-10 1.5486e-10 7.72169e-11 ] [ 6.127040000000001e-12 2.84226e-10 2.786300000000001e-10 ] [ 1.84412e-10 4.4971e-10 3.9905e-10 ] [ 2.88701e-10 3.05191e-11 2.51679e-10 ] [ 4.25223e-10 1.88781e-10 3.92663e-10 ] [ 2.58737e-10 2.78734e-10 -6.247970000000001e-11 ] [ 3.988e-10 4.24006e-10 4.8768e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 260.4966822 282.0811717 -106.0942982 ] [ 11.1536305 13.2248629 13.0659371 ] [ 269.7673375 283.8327863 -336.3725543 ] [ -616.0168614 581.6361092 -367.6405256 ] [ 0.7954251 0.0025462 4.2643604 ] [ -276.5207633 -286.2300441 333.062781 ] [ 624.5601704 -579.0156358 371.9846547 ] [ -274.235621 -295.5317964 87.7296448 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.173616940168075e-07 4.519438584656106e-07 -1.699818041762235e-07 ] [ 1.787008602414182e-08 2.118856615166529e-08 2.093393895046335e-08 ] [ 4.322149211979631e-07 4.547502544263826e-07 -5.389282423782385e-07 ] [ -9.86967813353674e-07 9.318837759733158e-07 -5.890250549749438e-07 ] [ 1.274411498817502e-09 4.07946211188096e-12 6.832258535545337e-09 ] [ -4.430351021250307e-07 -4.585910848275729e-07 5.336254009768304e-07 ] [ 1.000655703297744e-06 -9.276853147564076e-07 5.959851170567009e-07 ] [ -4.393739005567695e-07 -4.734941348951056e-07 1.405583858496483e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 294.43445 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.717359921481067e-17 } }