{ "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" [ [ 2.719922 0.6324479 2.001085 ] [ 1.570016 2.535953 2.950979 ] [ 1.512501 2.471908 5.050939 ] [ 3.556391 2.380181 1.668166 ] [ 3.168972 1.023761 5.396195 ] [ 4.64835 1.331065 3.67677 ] [ 3.603196 3.529371 4.833641 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.719922e-10 6.324478999999999e-11 2.001085e-10 ] [ 1.570016e-10 2.535953e-10 2.950979e-10 ] [ 1.512501e-10 2.471908e-10 5.050939e-10 ] [ 3.556391e-10 2.380181e-10 1.668166e-10 ] [ 3.168972e-10 1.023761e-10 5.396195e-10 ] [ 4.64835e-10 1.331065e-10 3.67677e-10 ] [ 3.603196e-10 3.529371e-10 4.833641e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.8690321 -10.0960207 -0.958008 ] [ -5.2008882 2.8482 -5.7291722 ] [ -2.596426 1.0460216 5.2296152 ] [ 5.695636 8.7856229 -3.2910362 ] [ 1.213616 -1.71471 5.5016749 ] [ 4.1039585 -0.7276426 -1.1807085 ] [ 0.6531357 -0.1414712 0.4276348 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.198872826815951e-09 -1.617560846192032e-08 -1.534898032785072e-09 ] [ -8.332741550086317e-09 4.563319488958799e-09 -9.179145831002374e-09 ] [ -4.159933069110084e-09 1.675911366179294e-09 8.378767278251235e-09 ] [ 9.125414914969223e-09 1.407611972551532e-08 -5.272821301288151e-09 ] [ 1.944427197848544e-09 -2.74726829608614e-09 8.814654972644288e-09 ] [ 6.575266415605689e-09 -1.165811971623008e-09 -1.891703570265189e-09 ] [ 1.046438757371234e-09 -2.266618510239408e-10 6.85146484445263e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -16.440594 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.63407355558806e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6737453 0.6205594 2.0314471 ] [ 1.4759963 2.6320003 2.7899958 ] [ 1.364182 2.3338297 5.1840565 ] [ 3.8167571 2.7643605 1.9466844 ] [ 3.4389441 1.2489839 5.7205431 ] [ 4.5401582 1.0296212 3.5822903 ] [ 3.469565 3.2753318 4.3227578 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6737453e-10 6.205594e-11 2.0314471e-10 ] [ 1.4759963e-10 2.6320003e-10 2.7899958e-10 ] [ 1.364182e-10 2.3338297e-10 5.1840565e-10 ] [ 3.8167571e-10 2.7643605e-10 1.9466844e-10 ] [ 3.4389441e-10 1.2489839e-10 5.720543100000001e-10 ] [ 4.5401582e-10 1.0296212e-10 3.5822903e-10 ] [ 3.469565e-10 3.2753318e-10 4.3227578e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.34e-05 -1.99e-05 5.71e-05 ] [ -0.0002691 0.0001333 -6.55e-05 ] [ -1.16e-05 5.96e-05 2.7e-06 ] [ -3.19e-05 -1.28e-05 6.62e-05 ] [ -3.78e-05 -5.86e-05 -8.19e-05 ] [ 0.000327 -0.0001073 4.43e-05 ] [ 1e-05 5.6e-06 -2.3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.14691668956e-14 -3.18833150166e-14 9.148428580139999e-14 ] [ -4.311457322093999e-13 2.135701453122e-13 -1.04942569527e-13 ] [ -1.85852489544e-14 9.54897273864e-14 4.3258769118e-15 ] [ -5.11094346246e-14 -2.05078609152e-14 1.060640931708e-13 ] [ -6.056227676519999e-14 -9.38875507524e-14 -1.312182663246e-13 ] [ 5.239117593179999e-13 -1.719135528282e-13 7.09764248862e-14 ] [ 1.602176634e-14 8.972189150399999e-15 -3.6850062582e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.254434 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.565553415769516e-18 } }