{ "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" [ [ 6.9675513 2.9444694 -0.7512437 ] [ -0.9717474 -1.120238 5.4396115 ] [ 7.015663 6.5636369 -8.7982441 ] [ -14.2388717 11.1607614 -7.9525967 ] [ 0.8297377 1.1462635 -2.4679825 ] [ -6.5429634 -5.9396304 0.9964465 ] [ 11.0906161 -8.9953854 7.1925083 ] [ -4.1499857 -5.7598775 6.3415007 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.116324779708465e-08 4.717560033341004e-09 -1.203625092663289e-09 ] [ -1.556910965603186e-09 -1.794819133331751e-09 8.71521837153482e-09 ] [ 1.124033123801159e-08 1.051610558860019e-08 -1.409634100111154e-08 ] [ -2.281318734431075e-08 1.788151098540708e-08 -1.274146450739123e-08 ] [ 1.329386344336364e-09 1.836516580976381e-09 -3.954143862043536e-09 ] [ -1.048298299023008e-08 -9.516336963072954e-09 1.596483286177987e-09 ] [ 1.776912582568808e-08 -1.441219618296566e-08 1.152366864316995e-08 ] [ -6.649010065194323e-09 -9.228341069171953e-09 1.016020416232684e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -21.367571 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.423462269948408e-18 } }