{ "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" [ 5.40884 0 0 ] "si-unit" "m" "si-value" [ 5.40884e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0760511 5.4684 0 ] "si-unit" "m" "si-value" [ 7.60511e-12 5.4684e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0640574 0.226818 5.41063 ] "si-unit" "m" "si-value" [ 6.40574e-12 2.26818e-11 5.41063e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00830896 0.0131794 0.144184 ] [ 1.38941 1.30499 1.31845 ] [ 0.000666759 2.66681 2.72971 ] [ 1.38566 4.09949 4.22322 ] [ 2.74889 -0.0321093 2.66684 ] [ 4.05308 1.21875 4.179 ] [ 2.6535 2.74282 -0.0977168 ] [ 4.21539 3.9917 1.44444 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.308960000000001e-13 1.31794e-12 1.44184e-11 ] [ 1.38941e-10 1.30499e-10 1.31845e-10 ] [ 6.667589999999999e-14 2.66681e-10 2.72971e-10 ] [ 1.38566e-10 4.099490000000001e-10 4.223220000000001e-10 ] [ 2.74889e-10 -3.21093e-12 2.66684e-10 ] [ 4.05308e-10 1.21875e-10 4.179e-10 ] [ 2.6535e-10 2.74282e-10 -9.771680000000001e-12 ] [ 4.21539e-10 3.9917e-10 1.44444e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4930772 -2.6036181 -0.498668 ] [ 0.4086499 1.0183294 0.9873873 ] [ 1.3598171 -0.810027 1.6214342 ] [ -1.5304449 1.8516428 -2.7276796 ] [ -0.5104989 -0.6024963 1.1161466 ] [ -0.8849376 2.7684628 -1.4637862 ] [ 2.6783289 -2.2505375 2.439102 ] [ -2.0139918 0.6282439 -1.4739363 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.899967685981447e-10 -4.171456083679475e-09 -7.989542177235119e-10 ] [ 6.547293212664366e-10 1.631543570395239e-09 1.581968860768348e-09 ] [ 2.178667184133641e-09 -1.297806332309118e-09 2.597823988808483e-09 ] [ -2.452043058404466e-09 2.966658828674335e-09 -4.370224520158466e-09 ] [ -8.179094092627025e-10 -9.65305493931454e-10 1.788264002638544e-09 ] [ -1.417826345268038e-09 4.435566410258214e-09 -2.345244046811651e-09 ] [ 4.291155981746922e-09 -3.605758596440775e-09 3.907872232342668e-09 ] [ -3.226770603027601e-09 1.006557697033033e-09 -2.361506299864414e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.463133 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.681820306103431e-18 } }