{ "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" [ [ 3.032432 2.348999 1.593337 ] [ 4.810482 1.062628 3.508091 ] [ 5.121871 3.223017 1.668157 ] [ 3.284691 4.649431 1.699114 ] [ 3.943916 3.285754 3.641374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.032432e-10 2.348999e-10 1.593337e-10 ] [ 4.810482000000001e-10 1.062628e-10 3.508091e-10 ] [ 5.121871e-10 3.223017e-10 1.668157e-10 ] [ 3.284691e-10 4.649431e-10 1.699114e-10 ] [ 3.943916e-10 3.285754e-10 3.641374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.1353923 -8.9637913 -3.5857718 ] [ 0.9648718 -2.6476843 0.8094004 ] [ 14.325329 0.2221172 -5.6330756 ] [ -4.0661108 9.3573519 -1.3306825 ] [ -2.0886977 2.0320065 9.7401295 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.463651196489634e-08 -1.436157685459044e-08 -5.745039745483934e-09 ] [ 1.545895040029213e-09 -4.242057884719213e-09 1.296802397746168e-09 ] [ 2.295170720906824e-08 3.558709849175578e-10 -9.025182029518931e-09 ] [ -6.514627661342384e-09 1.499213044677846e-08 -2.131988391207696e-09 ] [ -3.346462622858732e-09 3.255633307613636e-09 1.56054077684644e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.129741 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.820927721759214e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.3420254 1.7302735 1.3520091 ] [ 5.6123683 1.7823719 3.7133963 ] [ 4.7646503 2.7795612 1.4195653 ] [ 4.16164 5.2292506 2.2006371 ] [ 3.312708 3.0483716 3.4244652 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3420254e-10 1.7302735e-10 1.3520091e-10 ] [ 5.612368300000001e-10 1.7823719e-10 3.7133963e-10 ] [ 4.7646503e-10 2.7795612e-10 1.4195653e-10 ] [ 4.16164e-10 5.229250600000001e-10 2.2006371e-10 ] [ 3.312708e-10 3.0483716e-10 3.424465200000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.9e-06 4e-06 4.1e-06 ] [ 1.1e-06 4.3e-06 1e-06 ] [ -6e-06 -3.6e-06 -1.6e-06 ] [ 3.1e-06 -2e-07 3e-06 ] [ -3.1e-06 -4.5e-06 -6.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.850665441919999e-15 6.4087064832e-15 6.568924145279999e-15 ] [ 1.76239428288e-15 6.889359469440001e-15 1.6021766208e-15 ] [ -9.6130597248e-15 -5.76783583488e-15 -2.56348259328e-15 ] [ 4.96674752448e-15 -3.2043532416e-16 4.8065298624e-15 ] [ -4.96674752448e-15 -7.2097947936e-15 -1.025393037312e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.793383 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.049725914354017e-18 } }