{ "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" [ [ 0.5458422 1.4711779 1.0160282 ] [ -5.163345 -0.8042516 -1.9222244 ] [ -2.5856021 -1.4321211 -3.2025074 ] [ 0.7036324 -2.8378598 -8.3493131 ] [ 4.7071313 0.0030774 11.1980603 ] [ 1.7923412 3.5999771 1.2599565 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.745356114860379e-10 2.357086836417641e-09 1.627856628113507e-09 ] [ -8.272590644124576e-09 -1.288553110760993e-09 -3.079742993611307e-09 ] [ -4.142591235311384e-09 -2.294510944574379e-09 -5.130982484218994e-09 ] [ 1.127343380917394e-09 -4.546752624668164e-09 -1.337707424855917e-08 ] [ 7.541655719895912e-09 4.93053833284992e-12 1.794127041096864e-08 ] [ 2.871647167136617e-09 5.767799145035384e-09 2.018672847524995e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.3625569304906797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.387410100141178e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.04243 0.0300365 0.7367706 ] [ 0.3988618 1.6526317 2.3399314 ] [ 1.1429019 2.3353172 0.1957602 ] [ 3.1433152 1.1004528 0.4967399 ] [ 2.3992749 0.4177688 2.6409116 ] [ 2.4997474 2.7230491 2.0999004 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.04243e-10 3.00365e-12 7.367706000000001e-11 ] [ 3.988618e-11 1.6526317e-10 2.3399314e-10 ] [ 1.1429019e-10 2.3353172e-10 1.957602e-11 ] [ 3.1433152e-10 1.1004528e-10 4.967399e-11 ] [ 2.3992749e-10 4.177688e-11 2.6409116e-10 ] [ 2.4997474e-10 2.7230491e-10 2.0999004e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.6e-06 -1.44e-05 1.4e-06 ] [ 2.96e-05 5e-07 -1.19e-05 ] [ 1.09e-05 4.5e-06 4e-06 ] [ -3.01e-05 6.9e-06 1.28e-05 ] [ -6.8e-06 -8.7e-06 -3.7e-06 ] [ -7.1e-06 1.12e-05 -2.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.76783583488e-15 -2.307134333952e-14 2.24304726912e-15 ] [ 4.742442797568e-14 8.010883104e-16 -1.906590178752e-14 ] [ 1.746372516672e-14 7.2097947936e-15 6.4087064832e-15 ] [ -4.822551628608e-14 1.105501868352e-14 2.050786074624e-14 ] [ -1.089480102144e-14 -1.393893660096e-14 -5.928053496960001e-15 ] [ -1.137545400768e-14 1.794437815296e-14 -4.005441552e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.32264193049068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.333434232432195e-18 } }