{ "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" [ [ 2.743488 1.903222 1.191758 ] [ 2.092285 1.109675 3.649357 ] [ 1.94045 3.241003 2.726585 ] [ 4.050079 0.1031898 2.277213 ] [ 5.000478 2.032764 2.106801 ] [ 4.158728 1.007331 4.48257 ] [ 3.981083 3.39009 3.613579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743488e-10 1.903222e-10 1.191758e-10 ] [ 2.092285e-10 1.109675e-10 3.649357e-10 ] [ 1.94045e-10 3.241003e-10 2.726585e-10 ] [ 4.050079e-10 1.031898e-11 2.277213e-10 ] [ 5.000478000000001e-10 2.032764e-10 2.106801e-10 ] [ 4.158728e-10 1.007331e-10 4.48257e-10 ] [ 3.981083e-10 3.39009e-10 3.613579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7899209 -1.5302968 -1.3252286 ] [ -1.1704023 -0.4576165 -0.6634331 ] [ -2.4882139 1.7227688 0.7069415 ] [ -1.4894532 -2.7913878 0.1035739 ] [ 1.8131367 2.1604229 -0.942654 ] [ 1.2381104 0.5492933 0.5048697 ] [ 1.3069014 0.3468162 1.6159306 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.265592798261295e-09 -2.451805755845053e-09 -2.123250280135515e-09 ] [ -1.875191201990548e-09 -7.331824575923232e-10 -1.062937002284869e-09 ] [ -3.986558138129589e-09 2.760179894403671e-09 1.132645143573283e-09 ] [ -2.386367094815747e-09 -4.472296272746346e-09 1.659436811050771e-10 ] [ 2.904965231054463e-09 3.461379061420936e-09 -1.510298200303603e-09 ] [ 1.983671536849336e-09 8.800648832220806e-10 8.088904298903098e-10 ] [ 2.093886868770789e-09 5.55660807354697e-10 2.589006228155316e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.103261158928927 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.138067896027264e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8946804 1.8741627 1.1933551 ] [ 2.1653186 1.2509485 3.6183296 ] [ 1.6853367 3.3510229 2.6465294 ] [ 3.793739 -0.0514279 2.3089167 ] [ 5.1175238 2.0312797 2.1584484 ] [ 4.5090676 1.0552066 4.3470169 ] [ 3.800925 3.2760822 3.775267 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8946804e-10 1.8741627e-10 1.1933551e-10 ] [ 2.1653186e-10 1.2509485e-10 3.6183296e-10 ] [ 1.6853367e-10 3.3510229e-10 2.6465294e-10 ] [ 3.793739e-10 -5.14279e-12 2.3089167e-10 ] [ 5.1175238e-10 2.0312797e-10 2.1584484e-10 ] [ 4.5090676e-10 1.0552066e-10 4.3470169e-10 ] [ 3.800925e-10 3.2760822e-10 3.775267e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.87e-05 -3.85e-05 -2.37e-05 ] [ -4.07e-05 4.54e-05 -1.68e-05 ] [ 1.88e-05 2.63e-05 4.2e-06 ] [ 4.3e-06 -4.41e-05 -5.5e-05 ] [ 5.5e-06 -4.9e-06 -1.09e-05 ] [ 8.82e-05 -8.4e-06 6.02e-05 ] [ -5.74e-05 2.42e-05 4.2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.996070280896e-14 -6.16837999008e-14 -3.797158591296e-14 ] [ -6.520858846656e-14 7.273881858432e-14 -2.691656722944e-14 ] [ 3.012092047104e-14 4.213724512704e-14 6.72914180736e-15 ] [ 6.889359469440001e-15 -7.065598897728e-14 -8.8119714144e-14 ] [ 8.8119714144e-15 -7.850665441919999e-15 -1.746372516672e-14 ] [ 1.4131197795456e-13 -1.345828361472e-14 9.645103257216e-14 ] [ -9.196493803392e-14 3.877267422336e-14 6.72914180736e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.103202158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.298276105265201e-18 } }