{ "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" [ [ 2.18156 2.402287 4.241396 ] [ 0.8961477 3.559566 3.04631 ] [ 5.464384 2.707991 2.659357 ] [ 3.611912 1.298545 2.707748 ] [ 3.448769 3.905478 2.40265 ] [ 4.321729 3.291274 4.492065 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.18156e-10 2.402287e-10 4.241396e-10 ] [ 8.961477e-11 3.559566e-10 3.04631e-10 ] [ 5.464384e-10 2.707991e-10 2.659357e-10 ] [ 3.611912e-10 1.298545e-10 2.707748e-10 ] [ 3.448769e-10 3.905478e-10 2.40265e-10 ] [ 4.321729000000001e-10 3.291274e-10 4.492065e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4769373 -3.8384611 5.8101999 ] [ 1.1099485 0.0764703 0.1157124 ] [ 2.7297348 -2.9364963 -1.1718409 ] [ -0.9591184 -8.7934774 -4.7489664 ] [ -0.3020874 10.4186646 -7.9093706 ] [ -1.1015401 5.0732999 7.9042656 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.366314431943048e-09 -6.149892684937936e-09 9.308966518649136e-09 ] [ 1.778333551643349e-09 1.225189278549702e-10 1.853917035440616e-10 ] [ 4.373517313576663e-09 -4.704785757687454e-09 -1.877496108745531e-09 ] [ -1.536677089719466e-09 -1.408870402188707e-08 -7.608683001731096e-09 ] [ -4.839973737058116e-10 1.669254097960296e-08 -1.267220876496656e-08 ] [ -1.764861809634023e-09 8.128322557054537e-09 1.266402965324999e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -7.9269191 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.270032456162831e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2885169 2.1180256 4.3527022 ] [ 1.5418578 3.7769019 2.8918635 ] [ 4.8893052 2.9432608 2.6683562 ] [ 3.60859 0.7407235 2.6639587 ] [ 3.1877246 4.2991474 1.8259627 ] [ 4.4085073 3.2870818 5.1466827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2885169e-10 2.1180256e-10 4.3527022e-10 ] [ 1.5418578e-10 3.7769019e-10 2.8918635e-10 ] [ 4.8893052e-10 2.9432608e-10 2.6683562e-10 ] [ 3.60859e-10 7.407235e-11 2.6639587e-10 ] [ 3.1877246e-10 4.2991474e-10 1.8259627e-10 ] [ 4.4085073e-10 3.2870818e-10 5.146682700000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.38e-05 -4.56e-05 6.92e-05 ] [ -5.33e-05 2.5e-05 1.31e-05 ] [ 5.12e-05 2.1e-06 1.78e-05 ] [ 2.6e-06 -4.64e-05 -3.93e-05 ] [ 2.77e-05 3.76e-05 -5.4e-05 ] [ 5.6e-06 2.73e-05 -6.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.415357022919999e-14 -7.30592545104e-14 1.108706230728e-13 ] [ -8.53960145922e-14 4.005441585e-14 2.09885139054e-14 ] [ 8.20314436608e-14 3.364570931399999e-15 2.851874408519999e-14 ] [ 4.165659248399999e-15 -7.43409958176e-14 -6.29655417162e-14 ] [ 4.438029276179999e-14 6.024184143839999e-14 -8.651753823599998e-14 ] [ 8.972189150399999e-15 4.37394221082e-14 -1.07345834478e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.314433 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.453642671555852e-18 } }