{ "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" [ [ 1.175063 2.090387 1.108777 ] [ 2.290473 2.943113 3.7458 ] [ 1.562387 4.346014 1.227002 ] [ 3.205072 1.346551 2.036178 ] [ 4.414518 1.768723 4.119804 ] [ 3.44377 3.554925 2.238453 ] [ 4.008705 3.851776 5.027783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.175063e-10 2.090387e-10 1.108777e-10 ] [ 2.290473e-10 2.943113e-10 3.7458e-10 ] [ 1.562387e-10 4.346014000000001e-10 1.227002e-10 ] [ 3.205072e-10 1.346551e-10 2.036178e-10 ] [ 4.414518e-10 1.768723e-10 4.119804e-10 ] [ 3.44377e-10 3.554925e-10 2.238453e-10 ] [ 4.008705e-10 3.851776e-10 5.027783000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1443933 0.0680166 0.1889703 ] [ -2.0830787 -0.3929139 1.9220858 ] [ -0.0495157 -0.4906304 0.3633307 ] [ -0.1316039 -1.1876426 -0.4037485 ] [ 0.1824441 -0.6071309 0.2729108 ] [ 2.050749 2.5414721 -1.9334913 ] [ -0.113388 0.0688291 -0.4100577 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.313435694601607e-10 1.089746063463053e-10 3.027637966855623e-10 ] [ -3.337459992426457e-09 -6.295174645673491e-10 3.079520931931665e-09 ] [ -7.933289690254657e-11 -7.860765563337524e-10 5.821199531588986e-10 ] [ -2.108526917861011e-10 -1.902813207586126e-09 -6.468764073830688e-10 ] [ 2.923076716228973e-10 -9.727309337452627e-10 4.372513033238247e-10 ] [ 3.28566210292898e-09 4.07188718103548e-09 -3.097794557380199e-09 ] [ -1.816676026792704e-10 1.102763748507053e-10 -6.569848601190202e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -19.804522 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.173034213451926e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4827488 1.8745951 1.7889011 ] [ 1.5936254 2.9419975 3.9695471 ] [ 1.7625821 4.1993247 1.8964682 ] [ 3.7880215 1.5910388 1.7530764 ] [ 3.5619476 1.5194475 4.0638667 ] [ 4.0696482 3.9308446 1.8609456 ] [ 3.8414144 3.8442408 4.1709921 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4827488e-10 1.8745951e-10 1.7889011e-10 ] [ 1.5936254e-10 2.9419975e-10 3.969547100000001e-10 ] [ 1.7625821e-10 4.1993247e-10 1.8964682e-10 ] [ 3.7880215e-10 1.5910388e-10 1.7530764e-10 ] [ 3.5619476e-10 1.5194475e-10 4.0638667e-10 ] [ 4.0696482e-10 3.9308446e-10 1.8609456e-10 ] [ 3.8414144e-10 3.8442408e-10 4.1709921e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.05e-05 -2.06e-05 5.8e-06 ] [ 5.13e-05 6.2e-06 -6.1e-06 ] [ -3.41e-05 1.81e-05 -3.26e-05 ] [ -5.6e-06 8.3e-06 1.99e-05 ] [ -1.4e-06 -6.6e-06 -1.5e-05 ] [ 2.47e-05 6.2e-06 8.2e-06 ] [ -1.44e-05 -1.14e-05 1.98e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.28446207264e-14 -3.300483838848e-14 9.292624400640001e-15 ] [ 8.219166064704e-14 9.93349504896e-15 -9.77327738688e-15 ] [ -5.463422276928e-14 2.899939683648e-14 -5.223095783807999e-14 ] [ -8.972189076479999e-15 1.329806595264e-14 3.188331475392e-14 ] [ -2.24304726912e-15 -1.057436569728e-14 -2.4032649312e-14 ] [ 3.957376253376001e-14 9.93349504896e-15 1.313784829056e-14 ] [ -2.307134333952e-14 -1.826481347712e-14 3.172309709184e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.96247 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.678993258982137e-18 } }