{ "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" [ [ 2.1688 2.788884 1.320769 ] [ 2.532136 2.630615 3.81334 ] [ 3.448306 1.022917 2.319133 ] [ 4.871015 2.854538 3.444822 ] [ 3.148673 5.011898 0.914954 ] [ 4.462028 3.106005 1.382629 ] [ 3.536809 5.003724 3.350012 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1688e-10 2.788884e-10 1.320769e-10 ] [ 2.532136e-10 2.630615e-10 3.813340000000001e-10 ] [ 3.448306e-10 1.022917e-10 2.319133e-10 ] [ 4.871015e-10 2.854538e-10 3.444822e-10 ] [ 3.148673e-10 5.011898e-10 9.149540000000001e-11 ] [ 4.462028e-10 3.106005e-10 1.382629e-10 ] [ 3.536809e-10 5.003724e-10 3.350012e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.5618177 0.3134987 -1.4343683 ] [ -2.9064054 1.3914141 2.2660338 ] [ 1.1322347 -4.072686 -0.4072524 ] [ 3.7915191 -0.3183866 6.3110152 ] [ -0.7683587 1.9858449 -0.3860256 ] [ 5.0111114 -2.711817 -9.9184695 ] [ -1.6982833 3.4121319 3.5690668 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.308837667291628e-09 5.02280287791193e-10 -2.298111355876641e-09 ] [ -4.656574782446873e-09 2.229291140871473e-09 3.630586376302583e-09 ] [ 1.814039965598502e-09 -6.525162293059469e-09 -6.524902740446899e-10 ] [ 6.074683259336658e-09 -5.101115668960013e-10 1.011136100695344e-08 ] [ -1.231046345528281e-09 3.181674271314914e-09 -6.184811913502926e-10 ] [ 8.028685529304356e-09 -4.344809797287993e-09 -1.589113994701787e-08 ] [ -2.720949798755073e-09 5.466837957265883e-09 5.718275385033469e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.983671 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.240431074915896e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9936104 2.7537215 1.240045 ] [ 2.3029099 2.7957656 3.8146431 ] [ 3.5870459 0.9917741 2.3836026 ] [ 4.9538873 2.9541445 3.4935885 ] [ 3.1989382 4.9859687 1.149391 ] [ 4.644599 2.9121049 0.9189816 ] [ 3.4867763 5.0251018 3.5454071 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9936104e-10 2.7537215e-10 1.240045e-10 ] [ 2.3029099e-10 2.7957656e-10 3.8146431e-10 ] [ 3.5870459e-10 9.917741e-11 2.3836026e-10 ] [ 4.9538873e-10 2.9541445e-10 3.4935885e-10 ] [ 3.1989382e-10 4.9859687e-10 1.149391e-10 ] [ 4.644599e-10 2.9121049e-10 9.189816e-11 ] [ 3.4867763e-10 5.0251018e-10 3.5454071e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.6e-06 8.1e-06 -3.07e-05 ] [ -1.18e-05 -1.12e-05 1.1e-05 ] [ -1.92e-05 -3.26e-05 2.87e-05 ] [ 3.34e-05 1.16e-05 -7e-06 ] [ -1.72e-05 2.83e-05 -3.8e-06 ] [ 1.31e-05 -4.4e-06 -7.4e-06 ] [ -9e-07 2e-07 9.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.16565921408e-15 1.297763062848e-14 -4.918682225856e-14 ] [ -1.890568412544e-14 -1.794437815296e-14 1.76239428288e-14 ] [ -3.076179111936e-14 -5.223095783807999e-14 4.598246901696e-14 ] [ 5.351269913472e-14 1.858524880128e-14 -1.12152363456e-14 ] [ -2.755743787776e-14 4.534159836864e-14 -6.08827115904e-15 ] [ 2.098851373248e-14 -7.04957713152e-15 -1.185610699392e-14 ] [ -1.44195895872e-15 3.2043532416e-16 1.457980724928e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.011061 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.725472422920267e-18 } }