{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0251564 0.6941165 0.4465085 ] [ 0.3172663 0.1337315 1.61278 ] [ 0.5869901 2.638721 0.7880578 ] [ 2.963349 2.149596 1.324349 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.51564e-12 6.941165e-11 4.465085e-11 ] [ 3.172663e-11 1.337315e-11 1.61278e-10 ] [ 5.869901e-11 2.638721e-10 7.880578e-11 ] [ 2.963349e-10 2.149596e-10 1.324349e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.139641 29.1099784 -60.4763096 ] [ 14.7528665 -32.7411033 61.6949287 ] [ 1.7144016 3.3541777 -0.9193872 ] [ -1.3276271 0.2769473 -0.299232 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.425637885750513e-08 4.663932682447299e-08 -9.68937293533826e-08 ] [ 2.363669779608352e-08 -5.245703024645773e-08 9.884617238506294e-08 ] [ 2.746774162182113e-09 5.373985092948716e-09 -1.473020677302774e-09 ] [ -2.127093100760504e-09 4.437184892536839e-10 -4.794225145952256e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 14.197241 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.274648761006321e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0113109 0.7648942 0.8622104 ] [ -0.7542011 -1.1563593 1.6340007 ] [ 1.405841 2.4361394 0.6477971 ] [ 3.2524327 3.5714906 1.0276871 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.13109e-12 7.648942e-11 8.622104e-11 ] [ -7.542011e-11 -1.1563593e-10 1.6340007e-10 ] [ 1.405841e-10 2.4361394e-10 6.477971000000001e-11 ] [ 3.2524327e-10 3.571490600000001e-10 1.0276871e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.1007118 0.1178233 -0.0147114 ] [ -0.0597766 -0.0699097 0.0086752 ] [ 0.0040033 -0.0540754 0.0366544 ] [ -0.0449384 0.0061618 -0.0306182 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.613580913986855e-10 1.887737366455047e-10 -2.357026113923712e-11 ] [ -9.577267099091329e-11 -1.120076869071418e-10 1.389920262076416e-11 ] [ 6.413993666048639e-12 -8.663834164040833e-11 5.872682272945151e-11 ] [ -7.199925385615873e-11 9.872291902045442e-12 -4.905576421097856e-11 ] ] } "relaxed-potential-energy" { "source-value" -8.4001611 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.345854172537361e-18 } }