{ "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" [ [ 2.570437 1.678388 2.565083 ] [ 2.924882 3.183881 4.210831 ] [ 1.144354 3.791418 3.165706 ] [ 4.144212 1.310941 0.7169232 ] [ 4.636642 2.415393 2.866782 ] [ 3.821758 3.649635 1.198039 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.570437e-10 1.678388e-10 2.565083e-10 ] [ 2.924882e-10 3.183881e-10 4.210831e-10 ] [ 1.144354e-10 3.791418000000001e-10 3.165706e-10 ] [ 4.144212e-10 1.310941e-10 7.169232e-11 ] [ 4.636642e-10 2.415393e-10 2.866782e-10 ] [ 3.821758e-10 3.649635e-10 1.198039e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.3150998 -5.2929963 -2.0961525 ] [ 2.0790483 1.9261885 5.9557153 ] [ -3.6692062 1.5928314 -1.4655598 ] [ 0.6290424 -2.2303757 -2.3935497 ] [ 7.8987015 -0.210852 3.5044227 ] [ -0.6224862 4.2152041 -3.504876 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.011790525757875e-08 -8.480314925840904e-09 -3.358406529131472e-09 ] [ 3.331002579773985e-09 3.086094181953821e-09 9.542107813800858e-09 ] [ -5.878716390534409e-09 2.551997229956133e-09 -2.348085647944324e-09 ] [ 1.007837026771922e-09 -3.573455802140435e-09 -3.834889370062853e-09 ] [ 1.265511487797789e-08 -3.378221448489216e-10 5.614704119340813e-09 ] [ -9.973328364106329e-10 6.753501460920306e-09 -5.61543038600302e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.0872453 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.455937196713468e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4724808 1.4881999 1.8390562 ] [ 3.1382875 3.6171295 4.4258136 ] [ 1.114734 2.7039925 3.7746385 ] [ 3.6985386 1.5767774 1.1913675 ] [ 4.835669 3.0300529 2.9571742 ] [ 4.9825752 3.6135038 0.5353141 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4724808e-10 1.4881999e-10 1.8390562e-10 ] [ 3.1382875e-10 3.6171295e-10 4.4258136e-10 ] [ 1.114734e-10 2.7039925e-10 3.7746385e-10 ] [ 3.6985386e-10 1.5767774e-10 1.1913675e-10 ] [ 4.835669000000001e-10 3.0300529e-10 2.9571742e-10 ] [ 4.9825752e-10 3.6135038e-10 5.353141e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.97e-05 1.82e-05 -1.65e-05 ] [ -1.99e-05 1.2e-05 -1.18e-05 ] [ -2.05e-05 -1.76e-05 3.89e-05 ] [ -1.38e-05 -6.6e-06 -9e-07 ] [ 2.36e-05 -3.6e-06 1.9e-06 ] [ 1.09e-05 -2.4e-06 -1.17e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.156287942976e-14 2.915961449856e-14 -2.64359142432e-14 ] [ -3.188331475392e-14 1.92261194496e-14 -1.890568412544e-14 ] [ -3.28446207264e-14 -2.819830852608e-14 6.232467054911999e-14 ] [ -2.211003736704e-14 -1.057436569728e-14 -1.44195895872e-15 ] [ 3.781136825088e-14 -5.76783583488e-15 3.04413557952e-15 ] [ 1.746372516672e-14 -3.84522388992e-15 -1.874546646336e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.748985 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.363047894752989e-18 } }