{ "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" [ 5.36644 0 0 ] "si-unit" "m" "si-value" [ 5.366440000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.227231 5.37948 0 ] "si-unit" "m" "si-value" [ -2.27231e-11 5.379480000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0350261 -0.0899265 5.39939 ] "si-unit" "m" "si-value" [ -3.50261e-12 -8.992650000000001e-12 5.399390000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00104229 0.0077963 0.00224549 ] [ 1.32493 1.37357 1.36608 ] [ -0.0958533 2.66355 2.80902 ] [ 1.19786 4.07015 4.22336 ] [ 2.70129 0.113781 2.60003 ] [ 3.9906 1.45175 3.98519 ] [ 2.48193 2.86985 0.00162227 ] [ 4.00824 4.16333 1.43322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.04229e-13 7.7963e-13 2.24549e-13 ] [ 1.32493e-10 1.37357e-10 1.36608e-10 ] [ -9.58533e-12 2.66355e-10 2.80902e-10 ] [ 1.19786e-10 4.07015e-10 4.22336e-10 ] [ 2.70129e-10 1.13781e-11 2.60003e-10 ] [ 3.9906e-10 1.45175e-10 3.98519e-10 ] [ 2.48193e-10 2.86985e-10 1.62227e-13 ] [ 4.00824e-10 4.16333e-10 1.43322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9503616 4.9204871 -1.1954711 ] [ -3.0907747 1.702473 -1.2813826 ] [ 5.5087391 5.0762666 -4.4288368 ] [ -2.479299 2.4485151 -7.0140888 ] [ 1.2542357 -2.4351508 3.3234691 ] [ -4.9967826 -4.3939952 5.8346459 ] [ 6.7384859 -3.6002227 3.774534 ] [ -3.8849661 -3.718373 0.9871302 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.522647149370854e-09 7.88348945951842e-09 -1.915355863042277e-09 ] [ -4.95196700529836e-09 2.727662460615881e-09 -2.053001260934168e-09 ] [ 8.825973068822188e-09 8.133075734474625e-09 -7.09577883675933e-09 ] [ -3.972274926499566e-09 3.922953681216172e-09 -1.12378091841611e-08 ] [ 2.009507132068633e-09 -3.901541712026407e-09 5.324784535841009e-09 ] [ -8.005728326897768e-09 -7.039956439348157e-09 9.3481333286439e-09 ] [ 1.079624465751846e-08 -5.768192687136392e-09 6.047470179038556e-09 ] [ -6.224401909302107e-09 -5.957490337096482e-09 1.581556941155747e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.401463 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.511722019401554e-18 } }