{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.845445 0.9973996 1.833851 ] [ 2.258239 2.496991 3.58031 ] [ 1.78294 4.270758 1.69672 ] [ 2.678494 4.477221 3.72616 ] [ 4.64173 2.41566 3.489752 ] [ 3.528967 5.47506 1.628646 ] [ 3.443776 3.131475 0.8054665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.845445e-10 9.973996000000001e-11 1.833851e-10 ] [ 2.258239e-10 2.496991e-10 3.58031e-10 ] [ 1.78294e-10 4.270758e-10 1.69672e-10 ] [ 2.678494e-10 4.477221e-10 3.72616e-10 ] [ 4.64173e-10 2.41566e-10 3.489752e-10 ] [ 3.528967e-10 5.475060000000001e-10 1.628646e-10 ] [ 3.443776e-10 3.131475e-10 8.054665e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.698812 0.0728565 -1.1985097 ] [ -2.3692056 0.146151 0.5017957 ] [ -5.1454202 -2.2515778 -3.3511899 ] [ -0.7009624 -0.9255798 8.5110209 ] [ 4.5861018 0.563369 1.7192669 ] [ 4.5460102 9.2557687 -1.5969377 ] [ 0.7822884 -6.8609876 -4.5854463 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.72179686953449e-09 1.167289809733152e-10 -1.920224221142022e-09 ] [ -3.795885822188436e-09 2.341597153065408e-10 8.039653389579705e-10 ] [ -8.24387194863206e-09 -3.607425311072298e-09 -5.369198109641091e-09 ] [ -1.123065569339858e-09 -1.48294231624474e-09 1.363615870512017e-08 ] [ 7.347745084568797e-09 9.026166406834753e-10 2.754569232095292e-09 ] [ 7.283511260358332e-09 1.482937621867241e-08 -2.558576247814124e-09 ] [ 1.253364185203039e-09 -1.09925139283187e-08 -7.346694857793864e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.413894 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.66848974982894e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6845045 0.9717035 1.9297648 ] [ 2.0850555 2.5456041 3.6102157 ] [ 1.8569017 4.1918946 1.4552261 ] [ 2.7138019 4.2644176 3.8880947 ] [ 4.8785424 2.6628608 3.4907713 ] [ 3.6403315 5.9973864 1.9567791 ] [ 3.3204536 2.6306976 0.430054 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6845045e-10 9.717035000000001e-11 1.9297648e-10 ] [ 2.0850555e-10 2.5456041e-10 3.6102157e-10 ] [ 1.8569017e-10 4.191894600000001e-10 1.4552261e-10 ] [ 2.7138019e-10 4.2644176e-10 3.8880947e-10 ] [ 4.8785424e-10 2.6628608e-10 3.4907713e-10 ] [ 3.6403315e-10 5.9973864e-10 1.9567791e-10 ] [ 3.3204536e-10 2.6306976e-10 4.30054e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.33e-05 -3.81e-05 -8e-06 ] [ 7.5e-05 0.0002773 0.0001573 ] [ 2.9e-06 0.0001603 -2.72e-05 ] [ -0.0001946 -0.0002721 -0.0001432 ] [ 4.63e-05 7.9e-06 -6.33e-05 ] [ 1.42e-05 -0.0001037 5.72e-05 ] [ -2.71e-05 -3.16e-05 2.72e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.3346131251264e-13 -6.104292925248e-14 -1.28174129664e-14 ] [ 1.2016324656e-13 4.4428357694784e-13 2.5202238245184e-13 ] [ 4.646312200320001e-15 2.5682891231424e-13 -4.357920408576e-14 ] [ -3.1178357040768e-13 -4.3595225851968e-13 -2.2943169209856e-13 ] [ 7.418077754303999e-14 1.265719530432e-14 -1.0141778009664e-13 ] [ 2.275090801536e-14 -1.6614571557696e-13 9.164450270976e-14 ] [ -4.341898642368e-14 -5.062878121728e-14 4.357920408576e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.618845 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.662632492369898e-18 } }