{ "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" [ [ 25.355427 15.3684773 -9.7051949 ] [ -4.1654218 0.5978901 11.5926491 ] [ 22.7829425 19.787134 -30.3774944 ] [ -31.0268222 26.007021 -21.2981916 ] [ -0.520558 2.0998488 -1.6960621 ] [ -17.2602297 -18.0485386 15.4917866 ] [ 27.007935 -23.3268105 20.8198305 ] [ -22.1732729 -22.485022 15.1726767 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.062387234980108e-08 2.462301502735551e-08 -1.55494363690874e-08 ] [ -6.673741423730653e-09 9.57925540027774e-10 1.857347136115816e-08 ] [ 3.65022978265307e-08 3.170248348743679e-08 -4.867011132616292e-08 ] [ -4.971044914655843e-08 4.166784102285463e-08 -3.412346464683894e-08 ] [ -8.340258573704064e-10 3.364328654574935e-09 -2.717391044044952e-09 ] [ -2.76539364949778e-08 -2.891694658452637e-08 2.482057830494272e-08 ] [ 4.327148203308605e-08 -3.737367042093196e-08 3.335704567611877e-08 ] [ -3.552549944699822e-08 -3.602497656657366e-08 2.43093078836969e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.5417102 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.072268659288892e-19 } }