{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0900209 0.6645307 1.771827 ] [ 2.257627 0.9336486 1.950206 ] [ 2.208369 3.070111 3.037465 ] [ 1.738494 0.324563 4.412062 ] [ 4.235476 0.6031948 3.631674 ] [ 3.30736 2.214082 5.333714 ] [ 4.556657 2.857436 3.382282 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.002090000000001e-12 6.645307e-11 1.771827e-10 ] [ 2.257627e-10 9.336486e-11 1.950206e-10 ] [ 2.208369e-10 3.070111e-10 3.037465e-10 ] [ 1.738494e-10 3.24563e-11 4.412062e-10 ] [ 4.235476000000001e-10 6.031948e-11 3.631674e-10 ] [ 3.30736e-10 2.214082e-10 5.333714e-10 ] [ 4.556657000000001e-10 2.857436e-10 3.382282e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8333731 -0.3669589 1.4052744 ] [ 2.3261866 0.4496626 2.2219331 ] [ 0.6885011 -3.0495129 2.2258667 ] [ 1.9969891 3.7653588 -3.5423468 ] [ -2.4698406 0.2299586 0.7724304 ] [ -0.9437846 -1.2281832 -3.4015066 ] [ -0.7646785 0.199675 0.3183488 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.33521089722362e-09 -5.879329703744851e-10 2.251497789488748e-09 ] [ 3.726961786138242e-09 7.204389049681421e-10 3.559929265801669e-09 ] [ 1.103100365815083e-09 -4.885858273208008e-09 3.566231587757248e-09 ] [ 3.199529248012433e-09 6.032769838283543e-09 -5.675465225725693e-09 ] [ -3.957120866422644e-09 3.684342926718989e-10 1.237569928075192e-09 ] [ -1.51210962119108e-09 -1.967766409099331e-09 -5.449814350016897e-09 ] [ -1.225150015128413e-09 3.1991461675824e-10 5.10051004619735e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -25.034203 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.010921476696122e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3900558 1.1419373 2.3066122 ] [ 2.6812458 0.8129771 1.8860954 ] [ 1.946558 2.7659695 3.1214511 ] [ 1.7832174 0.4441579 4.1003614 ] [ 4.1543357 0.5377988 3.7189624 ] [ 3.1075765 2.1357418 5.118602 ] [ 4.3310147 2.8289838 3.2671455 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.900558e-11 1.1419373e-10 2.3066122e-10 ] [ 2.6812458e-10 8.129771e-11 1.8860954e-10 ] [ 1.946558e-10 2.7659695e-10 3.1214511e-10 ] [ 1.7832174e-10 4.441579e-11 4.1003614e-10 ] [ 4.1543357e-10 5.377988e-11 3.7189624e-10 ] [ 3.1075765e-10 2.1357418e-10 5.118602e-10 ] [ 4.3310147e-10 2.8289838e-10 3.2671455e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.71e-05 -1.71e-05 2.88e-05 ] [ -5.24e-05 3.71e-05 4.85e-05 ] [ 4.9e-06 -1.67e-05 -3.92e-05 ] [ -3.2e-06 -2.35e-05 -3.68e-05 ] [ -1.59e-05 -9e-06 -2.03e-05 ] [ -2.84e-05 1.48e-05 2.73e-05 ] [ 4.79e-05 1.45e-05 -8.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.546251883968001e-14 -2.739722021568e-14 4.614268667904e-14 ] [ -8.395405492992e-14 5.944075263168e-14 7.77055661088e-14 ] [ 7.850665441919999e-15 -2.675634956736e-14 -6.280532353535999e-14 ] [ -5.126965186560001e-15 -3.76511505888e-14 -5.896009964544001e-14 ] [ -2.547460827072e-14 -1.44195895872e-14 -3.252418540224e-14 ] [ -4.550181603071999e-14 2.371221398784e-14 4.373942174784e-14 ] [ 7.674426013632e-14 2.32315610016e-14 -1.329806595264e-14 ] ] } "relaxed-potential-energy" { "source-value" -29.471026 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.721778884818894e-18 } }