{ "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" [ [ 2.717363 2.851349 1.457488 ] [ 0.2108152 2.748454 1.624055 ] [ 2.409053 4.258926 3.949315 ] [ 4.77033 2.580775 2.438947 ] [ 3.623649 2.286945 4.240246 ] [ 4.139768 4.74377 1.918983 ] [ 5.145543 4.155434 3.91724 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.717363e-10 2.851349e-10 1.457488e-10 ] [ 2.108152e-11 2.748454e-10 1.624055e-10 ] [ 2.409053e-10 4.258926e-10 3.949315e-10 ] [ 4.770330000000001e-10 2.580775e-10 2.438947e-10 ] [ 3.623649e-10 2.286945e-10 4.240246e-10 ] [ 4.139768e-10 4.743769999999999e-10 1.918983e-10 ] [ 5.145543e-10 4.155434e-10 3.91724e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 52.0208352 2.4521607 -9.9932826 ] [ -78.6324389 -2.7993044 7.2638871 ] [ 5.1269084 17.2789222 -15.8284699 ] [ 45.2084837 -90.2891454 -80.0237166 ] [ 7.8878256 -9.9194578 51.6869895 ] [ -7.4203004 56.1920541 -19.8557991 ] [ -24.1913136 27.0847706 66.7503916 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.33465659519297e-08 3.928794543984562e-09 -1.601100374676744e-08 ] [ -1.259830552420645e-07 -4.484980064182571e-09 1.163803008775071e-08 ] [ 8.214212775463135e-09 2.76838851814621e-08 -2.536000441681651e-08 ] [ 7.24319756459579e-08 -1.446591578718918e-07 -1.282121278460449e-07 ] [ 1.263768976526773e-08 -1.58927233781722e-08 8.281168617643508e-08 ] [ -1.188863182019289e-08 9.002959535374878e-08 -3.181249710532168e-08 ] [ -3.875875707636109e-08 4.339458623505119e-08 1.069459168507647e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 49.451095 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.922938828195978e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0754664 3.0432666 0.8934694 ] [ 0.2021819 2.6867998 1.957683 ] [ 2.0829717 4.2335779 3.8659081 ] [ 4.9439469 1.8413121 2.4175977 ] [ 3.409717 1.9567426 4.7909834 ] [ 4.0077426 5.5748764 1.7239275 ] [ 5.2944946 4.2890777 3.8967049 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0754664e-10 3.0432666e-10 8.934694e-11 ] [ 2.021819e-11 2.6867998e-10 1.957683e-10 ] [ 2.0829717e-10 4.233577900000001e-10 3.8659081e-10 ] [ 4.943946900000001e-10 1.8413121e-10 2.4175977e-10 ] [ 3.409717e-10 1.9567426e-10 4.7909834e-10 ] [ 4.007742600000001e-10 5.5748764e-10 1.7239275e-10 ] [ 5.2944946e-10 4.2890777e-10 3.8967049e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.9e-06 -4.4e-06 -6.11e-05 ] [ -3.65e-05 -3.32e-05 -3.14e-05 ] [ -9.8e-06 6.8e-06 3.9e-05 ] [ -9.2e-06 -2.43e-05 -5.47e-05 ] [ 3.05e-05 4.49e-05 7.61e-05 ] [ 2.52e-05 3.33e-05 2e-07 ] [ -4.1e-06 -2.32e-05 3.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.24848882112e-15 -7.04957713152e-15 -9.789299153088e-14 ] [ -5.84794466592e-14 -5.319226381056e-14 -5.030834589312e-14 ] [ -1.570133088384e-14 1.089480102144e-14 6.248488821120001e-14 ] [ -1.474002491136e-14 -3.893289188544e-14 -8.763906115775999e-14 ] [ 4.88663869344e-14 7.193773027392e-14 1.2192564084288e-13 ] [ 4.037485084416e-14 5.335248147264001e-14 3.2043532416e-16 ] [ -6.568924145279999e-15 -3.717049760256e-14 5.110943420352001e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.005801 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.884847340097726e-18 } }