{ "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" [ [ 0.0450915 0.6744384 2.108849 ] [ 0.1091138 2.224666 0.3426204 ] [ 1.10319 2.788623 2.698849 ] [ 2.780637 1.123883 1.270131 ] [ 2.821139 0.9081744 2.973557 ] [ 2.438974 2.484533 0.05951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.50915e-12 6.744384e-11 2.108849e-10 ] [ 1.091138e-11 2.224666e-10 3.426204e-11 ] [ 1.10319e-10 2.788623e-10 2.698849e-10 ] [ 2.780637e-10 1.123883e-10 1.270131e-10 ] [ 2.821139e-10 9.081744000000001e-11 2.973557e-10 ] [ 2.438974e-10 2.484533e-10 5.951e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5549273 0.658097 -0.0278558 ] [ 0.6528838 0.0750782 0.3853653 ] [ 0.3723035 -1.0467345 -0.4153681 ] [ 0.4763726 -2.7471337 -1.1646784 ] [ -1.6125179 0.8201346 2.3708332 ] [ -1.4439692 2.2405584 -1.1482962 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.491268167103668e-09 1.054387627618618e-09 -4.462991151368064e-11 ] [ 1.046035160459063e-09 1.202885367717465e-10 6.174232741275782e-10 ] [ 5.964959635420128e-10 -1.677053544084778e-09 -6.654930588461166e-10 ] [ 7.632330425097101e-10 -4.401393388351801e-09 -1.866020503230751e-09 ] [ -2.583538480001513e-09 1.31400048202916e-09 3.79849352485645e-09 ] [ -2.313493693395279e-09 3.589770286017055e-09 -1.839773325393481e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.893597 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.386217291301702e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5991271 0.1779649 1.6836877 ] [ -0.0076598 2.2669794 0.8769864 ] [ 1.4990301 3.2950542 2.4059866 ] [ 2.8542869 0.5846244 1.040427 ] [ 2.1058518 1.2060385 3.212663 ] [ 2.2475092 2.6736563 0.2337656 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.991271e-11 1.779649e-11 1.6836877e-10 ] [ -7.6598e-13 2.2669794e-10 8.769864000000001e-11 ] [ 1.4990301e-10 3.2950542e-10 2.4059866e-10 ] [ 2.8542869e-10 5.846244000000001e-11 1.040427e-10 ] [ 2.1058518e-10 1.2060385e-10 3.212663e-10 ] [ 2.2475092e-10 2.673656300000001e-10 2.337656e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.72e-05 1.74e-05 -1.41e-05 ] [ -3.9e-06 -3.7e-06 2.31e-05 ] [ 3.16e-05 -1.52e-05 3.8e-06 ] [ 3.8e-06 1.75e-05 3.51e-05 ] [ -3.79e-05 4e-06 -4.17e-05 ] [ -2.07e-05 -2e-05 -6.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.357920408576e-14 2.787787320192e-14 -2.259069035328e-14 ] [ -6.24848882112e-15 -5.928053496960001e-15 3.701027994048e-14 ] [ 5.062878121728e-14 -2.435308463616e-14 6.08827115904e-15 ] [ 6.08827115904e-15 2.8038090864e-14 5.623639939008e-14 ] [ -6.072249392832e-14 6.4087064832e-15 -6.681076508736e-14 ] [ -3.316505605055999e-14 -3.2043532416e-14 -9.93349504896e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.930693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.033031374014222e-18 } }