{ "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" [ [ 0.0409622 2.87289 0.6143003 ] [ 0.4467191 2.12103 2.019138 ] [ 1.9155 0.4332474 1.113336 ] [ 2.832667 2.287938 0.2396185 ] [ 2.613397 2.701371 2.225579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.09622e-12 2.87289e-10 6.143003e-11 ] [ 4.467191e-11 2.12103e-10 2.019138e-10 ] [ 1.9155e-10 4.332474e-11 1.113336e-10 ] [ 2.832667e-10 2.287938e-10 2.396185e-11 ] [ 2.613397e-10 2.701371e-10 2.225579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.369937 15.9447512 -30.5207558 ] [ 6.8972975 -16.8021417 30.2914115 ] [ -1.2222893 -2.2631966 1.0551778 ] [ 0.7957405 0.9530488 -8.7299068 ] [ 0.8991883 2.1675384 7.9040733 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.180794085545206e-08 2.554630780758346e-08 -4.889964179477997e-08 ] [ 1.105068889224661e-08 -2.691999883289703e-08 4.853219171617888e-08 ] [ -1.958323356448216e-09 -3.626040710668245e-09 1.690581215875525e-09 ] [ 1.274916835827477e-09 1.526952518421739e-09 -1.398685269195771e-08 ] [ 1.440658483826182e-09 3.472779377777746e-09 1.266372155468327e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.7766427 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.846495420906672e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.1424586 3.1037507 0.1500795 ] [ 0.2514842 1.916265 2.3979694 ] [ 2.105537 0.4487901 1.38205 ] [ 2.5880462 2.4649231 -0.1428654 ] [ 2.7617192 2.4827475 2.4247383 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.424586e-11 3.1037507e-10 1.500795e-11 ] [ 2.514842e-11 1.916265e-10 2.3979694e-10 ] [ 2.105537e-10 4.487901e-11 1.38205e-10 ] [ 2.5880462e-10 2.4649231e-10 -1.428654e-11 ] [ 2.7617192e-10 2.4827475e-10 2.4247383e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.28e-05 -7.63e-05 0.00014 ] [ -1.58e-05 -1.49e-05 -9.7e-05 ] [ -6.47e-05 0.0001134 1.55e-05 ] [ 4.32e-05 -2.1e-05 3.99e-05 ] [ -5.4e-06 -1.2e-06 -9.83e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.857315993519999e-14 -1.222460771742e-13 2.2430472876e-13 ] [ -2.53143908172e-14 -2.38724318466e-14 -1.55411133498e-13 ] [ -1.036608282198e-13 1.816868302956e-13 2.4833737827e-14 ] [ 6.92140305888e-14 -3.364570931399999e-14 6.392684769659999e-14 ] [ -8.6517538236e-15 -1.9226119608e-15 -1.574939631222e-13 ] ] } "relaxed-potential-energy" { "source-value" -13.452824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.155380027411441e-18 } }