{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8070865 2.620947 2.881943 ] [ 2.981493 2.883992 2.450576 ] [ 2.14387 2.287305 4.61196 ] [ 1.117537 4.809867 2.516966 ] [ 2.97789 5.94727 2.412215 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.070865000000001e-11 2.620947e-10 2.881943e-10 ] [ 2.981493e-10 2.883992e-10 2.450576e-10 ] [ 2.14387e-10 2.287305e-10 4.61196e-10 ] [ 1.117537e-10 4.809867e-10 2.516966e-10 ] [ 2.97789e-10 5.947269999999999e-10 2.412215e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.1892655 -0.1744594 -0.7101041 ] [ 1.9275521 1.1745351 -1.0590874 ] [ 0.6311149 -0.675272 2.0152069 ] [ -1.7322089 -0.0493444 -0.2125763 ] [ 1.3628074 -0.2754592 -0.0334391 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.507590000824022e-09 -2.795147719587955e-10 -1.137712187354225e-09 ] [ 3.088278909993944e-09 1.88181267752899e-09 -1.696845071663858e-09 ] [ 1.01115753781853e-09 -1.081905011080858e-09 3.228717381254844e-09 ] [ -2.775304601921685e-09 -7.905844404740353e-11 -3.405847779961671e-10 ] [ 2.183458154933234e-09 -4.413342902242714e-10 -5.357534424059328e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -8.9118845 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.42784129931699e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8680502 2.7686465 2.7004652 ] [ 3.2844681 3.048625 2.5477866 ] [ 2.2687146 2.3514671 4.6483686 ] [ 0.6435424 5.0559425 2.5617829 ] [ 2.9631012 5.3246999 2.4152568 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.680502e-11 2.7686465e-10 2.7004652e-10 ] [ 3.2844681e-10 3.048625e-10 2.5477866e-10 ] [ 2.2687146e-10 2.3514671e-10 4.6483686e-10 ] [ 6.435424e-11 5.0559425e-10 2.5617829e-10 ] [ 2.9631012e-10 5.3246999e-10 2.4152568e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.7e-06 -1.76e-05 -1.52e-05 ] [ -1.56e-05 -7.9e-06 1.52e-05 ] [ 5.5e-06 1.28e-05 -7.6e-06 ] [ 9.8e-06 6.8e-06 1.28e-05 ] [ -2.3e-06 6e-06 -5.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.32587687616e-15 -2.819830852608e-14 -2.435308463616e-14 ] [ -2.499395528448e-14 -1.265719530432e-14 2.435308463616e-14 ] [ 8.8119714144e-15 2.050786074624e-14 -1.217654231808e-14 ] [ 1.570133088384e-14 1.089480102144e-14 2.050786074624e-14 ] [ -3.68500622784e-15 9.6130597248e-15 -8.33131842816e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.457994 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.675555348726667e-18 } }