{ "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" [ [ 0.1724043 0.1217148 2.355607 ] [ 0.0803944 1.628444 0.6781111 ] [ 0.0194903 2.198586 2.964695 ] [ 2.614645 0.684385 2.185781 ] [ 2.191382 2.601245 1.67848 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724043e-11 1.217148e-11 2.355607e-10 ] [ 8.03944e-12 1.628444e-10 6.781111e-11 ] [ 1.94903e-12 2.198586e-10 2.964695e-10 ] [ 2.614645e-10 6.84385e-11 2.185781e-10 ] [ 2.191382e-10 2.601245e-10 1.67848e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.4130367 -11.1963305 2.2787671 ] [ -4.1517709 0.869402 -9.2871189 ] [ -5.1096363 6.6920663 8.0696753 ] [ 6.224951 -8.5260122 2.2452334 ] [ 6.449493 12.1608744 -3.3065569 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.468287606672383e-09 -1.793849896584998e-08 3.650987371868216e-09 ] [ -6.651870270897775e-09 1.392935558476762e-09 -1.487960477616981e-08 ] [ -8.186539820651015e-09 1.072187217070356e-08 1.292904510310723e-08 ] [ 9.97347095782558e-09 -1.366017741549557e-08 3.597260461719295e-09 ] [ 1.033322690061326e-08 1.948386865216523e-08 -5.297688160524923e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 6.1555008 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.862199471075697e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.5212569 0.0782586 2.3207502 ] [ -0.1151186 1.257407 0.4986853 ] [ -0.1539148 2.014613 3.3161699 ] [ 2.9863234 1.0403733 2.0980559 ] [ 2.8822829 2.8437229 1.6290127 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.212569000000001e-11 7.82586e-12 2.3207502e-10 ] [ -1.151186e-11 1.257407e-10 4.986853e-11 ] [ -1.539148e-11 2.014613e-10 3.3161699e-10 ] [ 2.9863234e-10 1.0403733e-10 2.0980559e-10 ] [ 2.8822829e-10 2.8437229e-10 1.6290127e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-06 8e-06 1.06e-05 ] [ 7e-07 1.08e-05 2.36e-05 ] [ -1.7e-06 -1.88e-05 -3.41e-05 ] [ -5.2e-06 9.05e-05 -2.35e-05 ] [ 5.2e-06 -9.05e-05 2.35e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.6021766208e-15 1.28174129664e-14 1.698307218048e-14 ] [ 1.12152363456e-15 1.730350750464e-14 3.781136825088e-14 ] [ -2.72370025536e-15 -3.012092047104e-14 -5.463422276928e-14 ] [ -8.33131842816e-15 1.449969841824e-13 -3.76511505888e-14 ] [ 8.33131842816e-15 -1.449969841824e-13 3.76511505888e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.135307 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.065814150723059e-18 } }