{ "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" [ [ 2.026325 2.332401 2.957561 ] [ 3.78119 1.739305 1.09586 ] [ 4.095572 1.356929 3.585425 ] [ 3.432411 4.018052 0.5968462 ] [ 4.864307 3.437474 2.341714 ] [ 3.124173 4.42761 2.898506 ] [ 3.279186 3.336979 4.610213 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.026325e-10 2.332401e-10 2.957561e-10 ] [ 3.78119e-10 1.739305e-10 1.09586e-10 ] [ 4.095572e-10 1.356929e-10 3.585425e-10 ] [ 3.432411e-10 4.018052e-10 5.968462e-11 ] [ 4.864307000000001e-10 3.437474e-10 2.341714e-10 ] [ 3.124173e-10 4.42761e-10 2.898506e-10 ] [ 3.279186e-10 3.336979e-10 4.610213e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0459432 -0.8025606 -1.4512983 ] [ -0.6345627 -0.0189876 1.268873 ] [ -0.0499788 0.7825878 -1.0664663 ] [ -0.6405752 -0.3752478 -0.1485537 ] [ 4.1573245 -2.4528753 0.1475414 ] [ -3.9245803 5.3484279 -2.7043962 ] [ 1.1383158 -2.4813445 3.9543002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.360912092473855e-11 -1.28584383009522e-09 -2.325236206066785e-09 ] [ -1.016681522371724e-09 -3.042148880510208e-11 2.032958655364358e-09 ] [ -8.007486489563904e-11 1.253843876883306e-09 -1.708667372731079e-09 ] [ -1.026314609304284e-09 -6.012132521666343e-10 -2.38009265073337e-10 ] [ 6.660768118979049e-09 -3.929939459397786e-09 2.363873816801011e-10 ] [ -6.28787080311225e-09 8.569126139414441e-09 -4.332920365020362e-09 ] [ 1.823782961847249e-09 -3.975552146050666e-09 6.335487332064765e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.734963085572456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.239277701845522e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1385992 2.5189956 2.6368018 ] [ 3.8774011 1.6214391 1.2035616 ] [ 4.0651638 1.3001934 3.465059 ] [ 3.1884267 3.7784554 0.849416 ] [ 4.8908722 3.3806454 2.5306622 ] [ 2.950426 4.7903398 2.8920322 ] [ 3.4922749 3.2586812 4.5085923 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1385992e-10 2.5189956e-10 2.6368018e-10 ] [ 3.8774011e-10 1.6214391e-10 1.2035616e-10 ] [ 4.0651638e-10 1.3001934e-10 3.465059e-10 ] [ 3.1884267e-10 3.7784554e-10 8.49416e-11 ] [ 4.890872199999999e-10 3.3806454e-10 2.5306622e-10 ] [ 2.950426e-10 4.7903398e-10 2.8920322e-10 ] [ 3.4922749e-10 3.2586812e-10 4.5085923e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.19e-05 2.28e-05 1.4e-06 ] [ -3.61e-05 -3.32e-05 -2.07e-05 ] [ 8.8e-06 -1.74e-05 3.5e-05 ] [ -1.37e-05 3.72e-05 -3.89e-05 ] [ 4.11e-05 2.47e-05 2.13e-05 ] [ -1.64e-05 -3.98e-05 1.17e-05 ] [ -1.57e-05 5.7e-06 -9.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.110943420352001e-14 3.652962695424e-14 2.24304726912e-15 ] [ -5.783857601088001e-14 -5.319226381056e-14 -3.316505605055999e-14 ] [ 1.409915426304e-14 -2.787787320192e-14 5.6076181728e-14 ] [ -2.194981970496e-14 5.960097029376001e-14 -6.232467054911999e-14 ] [ 6.584945911488e-14 3.957376253376001e-14 3.412636202304e-14 ] [ -2.627569658112e-14 -6.376662950784e-14 1.874546646336e-14 ] [ -2.515417294656e-14 9.13240673856e-15 -1.570133088384e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.821491085572458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.573576339869981e-18 } }