{ "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" [ 5.21631 0 0 ] "si-unit" "m" "si-value" [ 5.21631e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.340777 5.491 0 ] "si-unit" "m" "si-value" [ 3.40777e-11 5.491e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0764414 0.261433 5.31631 ] "si-unit" "m" "si-value" [ 7.644140000000001e-12 2.61433e-11 5.31631e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.102562 0.0713388 -0.561849 ] [ 1.48031 1.58239 0.779774 ] [ 0.554166 2.97803 2.26105 ] [ 1.29704 4.12978 3.93608 ] [ 3.06699 -0.246774 2.56051 ] [ 4.28292 1.50929 4.5131 ] [ 2.82838 2.54855 -0.698649 ] [ 4.65405 4.12903 1.02077 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.02562e-11 7.133879999999999e-12 -5.61849e-11 ] [ 1.48031e-10 1.58239e-10 7.79774e-11 ] [ 5.541660000000001e-11 2.97803e-10 2.26105e-10 ] [ 1.29704e-10 4.12978e-10 3.93608e-10 ] [ 3.06699e-10 -2.46774e-11 2.56051e-10 ] [ 4.28292e-10 1.50929e-10 4.5131e-10 ] [ 2.82838e-10 2.54855e-10 -6.98649e-11 ] [ 4.65405e-10 4.12903e-10 1.02077e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 24.1249967 -27.6250011 10.4218151 ] [ 1.4491611 -4.7145819 2.8186738 ] [ -0.5706199 -4.24046 3.1881076 ] [ 3.8818352 0.3741582 -5.8494346 ] [ -2.7078868 2.8021155 1.8808041 ] [ -16.1857837 25.4301676 -15.1424019 ] [ -3.3218366 8.6559028 4.423478 ] [ -6.669866 -0.6823011 -1.741042 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.865250568961715e-08 -4.426013091199428e-08 1.669758849952042e-08 ] [ 2.321812034192811e-09 -7.553592897026843e-09 4.516013264021495e-09 ] [ -9.142338631432339e-10 -6.793965873437567e-09 5.107911461314799e-09 ] [ 6.219385603238491e-09 5.994675205206105e-10 -9.3718273610186e-09 ] [ -4.338512922732925e-09 4.489483942881303e-09 3.013380357324786e-09 ] [ -2.593248423346572e-08 4.074361999174565e-08 -2.42608023069375e-08 ] [ -5.322168938637762e-09 1.386828509807726e-08 7.087193034223143e-09 ] [ -1.068630336906881e-08 -1.093166870766123e-09 -2.789456788230874e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.321689 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.653716880296853e-18 } }