{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7266937 0.3281129 0.1138198 ] [ 0.6755994 0.7068783 2.528749 ] [ 1.24494 2.902842 0.1722514 ] [ 2.894919 0.4231749 1.051303 ] [ 2.63173 1.048668 2.819948 ] [ 2.452649 2.84958 1.823943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.266937e-11 3.281129e-11 1.138198e-11 ] [ 6.755994e-11 7.068783e-11 2.528749e-10 ] [ 1.24494e-10 2.902842e-10 1.722514e-11 ] [ 2.894919e-10 4.231749e-11 1.051303e-10 ] [ 2.63173e-10 1.048668e-10 2.819948e-10 ] [ 2.452649e-10 2.84958e-10 1.823943e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2515366 1.7297507 0.3673962 ] [ -7.3464193 -1.5797087 1.1448479 ] [ -1.981288 -1.7462701 -2.1789824 ] [ 3.9634572 -4.6004303 -8.669368 ] [ 3.0462384 0.0131478 8.4176797 ] [ 2.0664752 6.1835106 0.9184266 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.030060597955213e-10 2.771366131352435e-09 5.88633602210761e-10 ] [ -1.17702612490539e-08 -2.530972346814361e-09 1.834248539751976e-09 ] [ -3.17437331267159e-09 -2.797833127822078e-09 -3.491114658414674e-09 ] [ 6.35015846338143e-09 -7.370701872279932e-09 -1.388985872671166e-08 ] [ 4.880611945863199e-09 2.106509777495424e-11 1.348660961672276e-08 ] [ 3.310858252903005e-09 9.90707611778898e-09 1.471481626440833e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.495238 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.200869509093175e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.865591 0.5941605 0.3285921 ] [ 0.3628636 0.3542739 2.5247383 ] [ 1.0257324 2.8494582 0.1825301 ] [ 3.0918526 0.490148 0.8478207 ] [ 2.411119 1.123083 3.1227964 ] [ 2.8693725 2.8481325 1.5035366 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.655910000000001e-11 5.941605e-11 3.285921e-11 ] [ 3.628636e-11 3.542739e-11 2.5247383e-10 ] [ 1.0257324e-10 2.8494582e-10 1.825301e-11 ] [ 3.0918526e-10 4.90148e-11 8.478207e-11 ] [ 2.411119e-10 1.123083e-10 3.1227964e-10 ] [ 2.8693725e-10 2.8481325e-10 1.5035366e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.1e-06 1.03e-05 -1.4e-05 ] [ 2.98e-05 1.58e-05 1.1e-06 ] [ -2.47e-05 -1.81e-05 4.6e-06 ] [ -5e-07 4e-07 8.2e-06 ] [ -2.78e-05 -9e-06 -2.1e-06 ] [ 2.43e-05 6e-07 2.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.76239428288e-15 1.650241919424e-14 -2.24304726912e-14 ] [ 4.774486329984001e-14 2.531439060864e-14 1.76239428288e-15 ] [ -3.957376253376001e-14 -2.899939683648e-14 7.370012455680001e-15 ] [ -8.010883104e-16 6.408706483200001e-16 1.313784829056e-14 ] [ -4.454051005824e-14 -1.44195895872e-14 -3.36457090368e-15 ] [ 3.893289188544e-14 9.6130597248e-16 3.68500622784e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.421688 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.829956148367191e-18 } }