{ "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" [ [ 2.285903 1.887977 1.671083 ] [ 2.68762 1.716714 3.675724 ] [ 2.821512 3.759774 2.999624 ] [ 4.480266 2.258259 2.346621 ] [ 5.253697 4.060686 3.32016 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.285903e-10 1.887977e-10 1.671083e-10 ] [ 2.68762e-10 1.716714e-10 3.675724e-10 ] [ 2.821512e-10 3.759774e-10 2.999624e-10 ] [ 4.480266000000001e-10 2.258259e-10 2.346621e-10 ] [ 5.253697e-10 4.060686e-10 3.32016e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -38.0437862 9.2559643 -104.4307013 ] [ -11.9141413 -65.5254747 136.2141625 ] [ -2.6626152 111.2618053 17.0098107 ] [ 79.6056975 -126.4985762 -81.2397395 ] [ -26.9851548 71.5062813 32.4464677 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.095286481635366e-08 1.482968960441944e-08 -1.673164281166082e-07 ] [ -1.908855864776772e-08 -1.049833836311619e-07 2.182391465793521e-07 ] [ -4.265979823626716e-09 1.782610632396615e-07 2.725272102777368e-08 ] [ 1.27542387416977e-07 -2.026730613521273e-07 -1.301604113067823e-07 ] [ -4.32349841292289e-08 1.145656921392082e-07 5.198497197648235e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 81.189978 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.300806845948663e-17 } "relaxed-configuration-positions" { "source-value" [ [ 2.3979585 2.3003654 1.1241527 ] [ 2.77391 1.480182 4.2588563 ] [ 2.2627135 4.2406389 3.3452429 ] [ 4.9705932 1.4367224 2.286847 ] [ 5.1238228 4.2255014 2.998113 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3979585e-10 2.3003654e-10 1.1241527e-10 ] [ 2.77391e-10 1.480182e-10 4.2588563e-10 ] [ 2.2627135e-10 4.2406389e-10 3.3452429e-10 ] [ 4.9705932e-10 1.4367224e-10 2.286847e-10 ] [ 5.123822800000001e-10 4.2255014e-10 2.998113e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.2e-06 1.93e-05 -1.87e-05 ] [ 1.9e-06 -1.12e-05 5.02e-05 ] [ -2.78e-05 1.91e-05 -1.06e-05 ] [ 2.16e-05 -3.37e-05 -2.96e-05 ] [ -9e-07 6.5e-06 8.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.33131842816e-15 3.092200878144e-14 -2.996070280896e-14 ] [ 3.04413557952e-15 -1.794437815296e-14 8.042926636416e-14 ] [ -4.454051005824e-14 3.060157345728e-14 -1.698307218048e-14 ] [ 3.460701500928e-14 -5.399335212096e-14 -4.742442797568e-14 ] [ -1.44195895872e-15 1.04141480352e-14 1.377871893888e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.133456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.943993953270549e-18 } }