
CalculationMode = em_resp

%Coordinates
 'O'  |  0.000000  | -0.553586  |  0.000000
 'H'  |  1.429937  |  0.553586  |  0.000000
 'H'  | -1.429937  |  0.553586  |  0.000000
%

Radius = 10
Spacing = 0.435
ConvRelDens = 1e-6


%EMFreqs
 3 | 0.0 | 0.3
%


EMEta = 0.1*eV

LinearSolver = qmr_dotp
ExperimentalFeatures = yes
