{ "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" [ [ 0.6977917 0.2559248 0.8783031 ] [ 0.349385 0.3940236 2.698898 ] [ 1.248694 1.36901 2.090768 ] [ 0.3246804 2.316928 0.2892628 ] [ 2.775341 0.8800459 0.0497676 ] [ 2.033969 2.77175 0.0650166 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.977917e-11 2.559248e-11 8.783031e-11 ] [ 3.49385e-11 3.940236e-11 2.698898e-10 ] [ 1.248694e-10 1.36901e-10 2.090768e-10 ] [ 3.246804e-11 2.316928e-10 2.892628e-11 ] [ 2.775341e-10 8.800459e-11 4.976760000000001e-12 ] [ 2.033969e-10 2.77175e-10 6.50166e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.7407502 -32.8156835 -26.5816668 ] [ -35.7605635 -38.0723025 41.1286635 ] [ 38.571398 45.0517284 14.5735977 ] [ -29.1472514 14.7191328 -10.750331 ] [ 18.5977611 -12.0183966 -7.534191 ] [ 19.4794059 23.1355214 -10.8360724 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.881075548109293e-08 -5.257652089927232e-08 -4.258852508885555e-08 ] [ -5.729473878633383e-08 -6.09985529655254e-08 6.58953831044503e-08 ] [ 6.179819210717188e-08 7.21808259691114e-08 2.334947751588465e-08 ] [ -4.669904475366007e-08 2.358265045061044e-08 -1.722392899406148e-08 ] [ 2.979689803364369e-08 -1.925559405202221e-08 -1.207110467684177e-08 ] [ 3.120944872005359e-08 3.706719149709808e-08 -1.736130186057615e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 30.540439 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.893117735476853e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.301064 -0.0271035 0.3360545 ] [ 0.650439 0.2228522 2.6707407 ] [ 1.905122 2.2348024 2.7626164 ] [ -0.1518081 2.2573463 -0.2844033 ] [ 2.6542713 0.4889652 0.1213608 ] [ 2.0707729 2.8108196 0.4656469 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.01064e-11 -2.71035e-12 3.360545e-11 ] [ 6.50439e-11 2.228522e-11 2.6707407e-10 ] [ 1.905122e-10 2.2348024e-10 2.762616400000001e-10 ] [ -1.518081e-11 2.2573463e-10 -2.844033e-11 ] [ 2.6542713e-10 4.889652e-11 1.213608e-11 ] [ 2.0707729e-10 2.8108196e-10 4.656469e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.54e-05 1.97e-05 4.76e-05 ] [ 5.3e-06 -2.68e-05 -1.7e-06 ] [ -6e-07 1.6e-06 -1.53e-05 ] [ 6.5e-06 3e-06 -4.53e-05 ] [ -2.74e-05 1.12e-05 -1.41e-05 ] [ 7e-07 -8.6e-06 2.88e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.467351996032e-14 3.156287942976e-14 7.626360715008e-14 ] [ 8.491536090240001e-15 -4.293833343744e-14 -2.72370025536e-15 ] [ -9.6130597248e-16 2.56348259328e-15 -2.451330229824e-14 ] [ 1.04141480352e-14 4.8065298624e-15 -7.257860092224001e-14 ] [ -4.389963940992e-14 1.794437815296e-14 -2.259069035328e-14 ] [ 1.12152363456e-15 -1.377871893888e-14 4.614268667904e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.112917 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.421356228949088e-18 } }