{ "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" [ [ 2.668149 2.195644 2.177876 ] [ 2.423331 4.799117 4.063095 ] [ 0.9419081 3.216694 3.792355 ] [ 4.815194 2.852634 0.7483411 ] [ 3.230766 2.566095 4.274755 ] [ 3.707939 4.705402 1.628358 ] [ 5.171828 3.316404 3.099703 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.668149e-10 2.195644e-10 2.177876e-10 ] [ 2.423331e-10 4.799117e-10 4.063095e-10 ] [ 9.419081e-11 3.216694e-10 3.792355e-10 ] [ 4.815194e-10 2.852634e-10 7.483411e-11 ] [ 3.230766e-10 2.566095e-10 4.274755e-10 ] [ 3.707939e-10 4.705402000000001e-10 1.628358e-10 ] [ 5.171828e-10 3.316404e-10 3.099703e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5189332 -0.8479456 -2.1130259 ] [ 1.6361143 1.9770316 -0.3202411 ] [ -1.8875099 -1.0337811 -0.6242322 ] [ -0.0837929 -1.0081461 -0.1674337 ] [ 1.891221 -0.3111329 1.4202361 ] [ -1.1868417 1.2694719 0.8205242 ] [ 0.1497424 -0.0454978 0.9841727 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.314226407969306e-10 -1.358558616030228e-09 -3.385440696124879e-09 ] [ 2.621344080416557e-09 3.167553808102817e-09 -5.130828034392749e-10 ] [ -3.024124233308546e-09 -1.656299909444907e-09 -1.00013023679055e-09 ] [ -1.342510253690323e-10 -1.615228111770699e-09 -2.682583596740409e-10 ] [ 3.030070070965997e-09 -4.984898583417043e-10 2.275469075436171e-09 ] [ -1.901530024330527e-09 2.033918198942556e-09 1.314624690040623e-09 ] [ 2.399137724224819e-10 -7.289551145783423e-11 1.576818490769612e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.044859 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.570669797383247e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5202006 1.6200325 2.6112228 ] [ 2.4188054 4.5713288 4.0727078 ] [ 1.0356855 3.3897983 2.6485469 ] [ 4.0745393 2.2749358 1.0324957 ] [ 3.7602924 2.7244026 4.1812659 ] [ 3.9632404 5.5155315 2.6372773 ] [ 5.1863515 3.5559605 2.6009666 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5202006e-10 1.6200325e-10 2.6112228e-10 ] [ 2.4188054e-10 4.5713288e-10 4.0727078e-10 ] [ 1.0356855e-10 3.3897983e-10 2.6485469e-10 ] [ 4.0745393e-10 2.2749358e-10 1.0324957e-10 ] [ 3.7602924e-10 2.7244026e-10 4.1812659e-10 ] [ 3.9632404e-10 5.5155315e-10 2.6372773e-10 ] [ 5.1863515e-10 3.5559605e-10 2.6009666e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9e-06 3.37e-05 4e-06 ] [ -7.4e-06 -2.34e-05 1.47e-05 ] [ 3.43e-05 1.53e-05 1.7e-06 ] [ 2.07e-05 -9e-06 2.2e-05 ] [ -1.56e-05 -4.6e-06 -6.1e-06 ] [ -2.04e-05 -1.85e-05 -5.6e-06 ] [ -2.7e-06 6.5e-06 -3.06e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.44195895872e-14 5.399335212096e-14 6.4087064832e-15 ] [ -1.185610699392e-14 -3.749093292672001e-14 2.355199632576e-14 ] [ 5.495465809344e-14 2.451330229824e-14 2.72370025536e-15 ] [ 3.316505605055999e-14 -1.44195895872e-14 3.52478856576e-14 ] [ -2.499395528448e-14 -7.370012455680001e-15 -9.77327738688e-15 ] [ -3.268440306432e-14 -2.96402674848e-14 -8.972189076479999e-15 ] [ -4.32587687616e-15 1.04141480352e-14 -4.902660459647999e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.636824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.985948369876434e-18 } }