{ "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" [ [ 2.290406 1.365127 2.478138 ] [ 1.892594 2.812526 4.141756 ] [ 2.634032 3.625436 1.937955 ] [ 4.696761 2.293416 2.137678 ] [ 4.185297 2.165547 4.431715 ] [ 4.453239 5.273552 2.545611 ] [ 3.870361 4.380343 4.592008 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.290406e-10 1.365127e-10 2.478138e-10 ] [ 1.892594e-10 2.812526e-10 4.141756e-10 ] [ 2.634032e-10 3.625436e-10 1.937955e-10 ] [ 4.696761000000001e-10 2.293416e-10 2.137678e-10 ] [ 4.185297000000001e-10 2.165547e-10 4.431715e-10 ] [ 4.453239e-10 5.273551999999999e-10 2.545611e-10 ] [ 3.870361e-10 4.380343e-10 4.592008e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2796822 -2.6226444 -1.1883891 ] [ -1.3893861 0.9362017 1.8017794 ] [ 1.027576 2.5524826 -1.1483797 ] [ 0.0117017 0.6409241 0.2833645 ] [ 1.4017861 -0.939434 0.2094087 ] [ -0.8727045 -1.7720324 -0.0205385 ] [ 0.1007089 1.2045024 0.0627548 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.481002820939097e-10 -4.201939542352043e-09 -1.904009232433553e-09 ] [ -2.226041926684491e-09 1.499960476093216e-09 2.886768830519052e-09 ] [ 1.646358243295181e-09 4.089527946718798e-09 -1.839907107141318e-09 ] [ 1.874819016361536e-11 1.026873608727281e-09 4.539999770646816e-10 ] [ 2.245908916782411e-09 -1.505139191584627e-09 3.35509723332121e-10 ] [ -1.398226746766953e-09 -2.839108882580114e-09 -3.29063045263008e-11 ] [ 1.613534450864851e-10 1.92982558497749e-09 1.005442734029798e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.771886 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.046281715272283e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7045553 1.5900234 2.6716409 ] [ 1.6733474 3.3699148 4.068081 ] [ 2.2162091 3.8646443 1.7948129 ] [ 4.9792547 2.4446147 2.145626 ] [ 4.4363183 1.9499036 4.4188823 ] [ 4.2676144 4.5863604 2.4895093 ] [ 3.7453909 4.1104858 4.6763087 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7045553e-10 1.5900234e-10 2.6716409e-10 ] [ 1.6733474e-10 3.3699148e-10 4.068081e-10 ] [ 2.2162091e-10 3.8646443e-10 1.7948129e-10 ] [ 4.9792547e-10 2.4446147e-10 2.145626e-10 ] [ 4.4363183e-10 1.9499036e-10 4.4188823e-10 ] [ 4.2676144e-10 4.5863604e-10 2.4895093e-10 ] [ 3.7453909e-10 4.1104858e-10 4.6763087e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.12e-05 -6.9e-06 1.14e-05 ] [ -4.84e-05 -1.34e-05 3.3e-06 ] [ 7e-06 -5.4e-06 -3.27e-05 ] [ -2.75e-05 2.93e-05 -1.97e-05 ] [ 2.51e-05 -1.74e-05 2.35e-05 ] [ 3.05e-05 2.2e-06 9.2e-06 ] [ 2.45e-05 1.17e-05 5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.794437815296e-14 -1.105501868352e-14 1.826481347712e-14 ] [ -7.754534844671999e-14 -2.146916671872e-14 5.28718284864e-15 ] [ 1.12152363456e-14 -8.65175375232e-15 -5.239117550016001e-14 ] [ -4.4059857072e-14 4.694377498944e-14 -3.156287942976e-14 ] [ 4.021463318208e-14 -2.787787320192e-14 3.76511505888e-14 ] [ 4.88663869344e-14 3.52478856576e-15 1.474002491136e-14 ] [ 3.92533272096e-14 1.874546646336e-14 8.010883104e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.445632 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.314445386308035e-18 } }