{ "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" [ [ 2.487281 5.921696 4.58109 ] [ 2.384555 3.657598 3.132891 ] [ 3.419185 2.494172 4.950415 ] [ 4.429689 2.154563 3.12196 ] [ 4.178368 4.562199 4.289341 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.487281e-10 5.921696e-10 4.58109e-10 ] [ 2.384555e-10 3.657598e-10 3.132891e-10 ] [ 3.419185e-10 2.494172e-10 4.950414999999999e-10 ] [ 4.429689e-10 2.154563e-10 3.12196e-10 ] [ 4.178368e-10 4.562199e-10 4.289341000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1845035 -2.2155128 -1.4095744 ] [ 6.9395039 -0.2784632 5.8724341 ] [ -4.6903932 5.9255037 3.2742022 ] [ 0.463002 3.7788898 -5.4747096 ] [ -1.5276092 -7.2104176 -2.2623523 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.897783814955773e-09 -3.549642811243146e-09 -2.258387148958188e-09 ] [ 1.111831090853042e-08 -4.461472287931546e-10 9.40867662220869e-09 ] [ -7.514838327399299e-09 9.493703494603897e-09 5.245850216611926e-09 ] [ 7.418109797836416e-10 6.054448890139588e-09 -8.771451726789319e-09 ] [ -2.447499745958992e-09 -1.155236250492485e-08 -3.624687963073107e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.809614 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.334067703867237e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4845908 5.1287919 4.7766208 ] [ 2.568475 3.78057 3.0207524 ] [ 3.1234976 3.0234911 5.0360788 ] [ 4.2750409 2.3872989 3.2536579 ] [ 4.4474737 4.4700761 3.988587 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4845908e-10 5.128791900000001e-10 4.7766208e-10 ] [ 2.568475e-10 3.78057e-10 3.0207524e-10 ] [ 3.1234976e-10 3.0234911e-10 5.0360788e-10 ] [ 4.2750409e-10 2.3872989e-10 3.2536579e-10 ] [ 4.4474737e-10 4.4700761e-10 3.988587e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.09e-05 4.31e-05 1.79e-05 ] [ -1.64e-05 -2.89e-05 -5.41e-05 ] [ 1.98e-05 -5.45e-05 1.42e-05 ] [ -3.25e-05 3.08e-05 2.22e-05 ] [ 5e-05 9.5e-06 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.348549137472e-14 6.905381235648e-14 2.867896151232001e-14 ] [ -2.627569658112e-14 -4.630290434112001e-14 -8.667775518528e-14 ] [ 3.172309709184e-14 -8.731862583360001e-14 2.275090801536e-14 ] [ -5.207074017599999e-14 4.934703992064001e-14 3.556832098176e-14 ] [ 8.010883104e-14 1.52206778976e-14 -3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -28.867458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.625076630952593e-18 } }