# al-split-t1-echo-selective-phase-filtering-p1.in # oQ -> 3Q -> (5Q, 1Q, -3Q) -> -1Q # approach: filtering the desired coherences (3Q) after the first pulse # and (5Q, 1Q, -3Q) after the second pulse # spin-5/2 echo amplitude optimization # versus the first-pulse duration # in three-pulse split-t1 phase-modulated 3Q-MAS sequence, # the second-pulse duration p2 = 4 micro seconds # the third-pulse duration p3 = 2 micro seconds spinsys { channels 27Al nuclei 27Al quadrupole 1 1 3e6 1 0 0 0 } par { spin_rate 5000 variable tsw 0.5 sw 1.0e6/tsw np 34 crystal_file rep10 gamma_angles 10 proton_frequency 800e6 start_operator 48*I1z detect_operator I1c verbose 1101 variable rf 90000 variable rf3 9000 variable p2 4 variable p3 2 } proc pulseq {} { global par maxdt $par(tsw) matrix set 1 coherence {3} matrix set 2 coherence {5 1 -3} acq -y for {set i 1} {$i < $par(np)} {incr i} { pulse $par(tsw) $par(rf) x store 2 filter 1 pulse $par(p2) $par(rf) x filter 2 pulse $par(p3) $par(rf3) x acq -y reset prop 2 } } proc main {} { global par fsave [fsimpson] $par(name).fid puts "Larmor frequency (Hz) of 27Al: " puts [resfreq 27Al $par(proton_frequency)] } # SIMP # NP=17 # SW=4000000 # TYPE=FID # DATA # 0 0 # -0.000685209338 -6.25104857e-20 # -0.0133621968 1.38187587e-18 # -0.073438793 4.20956062e-17 # -0.177974954 8.60906662e-17 # -0.276409656 4.59784938e-17 # -0.350511249 4.36769983e-17 # -0.418988113 2.01165407e-16 # -0.489066376 9.0281379e-17 # -0.540587541 -2.96787572e-17 # -0.541199235 2.51617757e-17 # -0.487321649 5.43608304e-17 # -0.401648033 8.72123479e-17 # -0.314194558 1.60592604e-16 # -0.238447304 7.23459903e-17 # -0.165826822 -3.04091048e-16 # -0.0959536221 -2.68018273e-16 # -0.0478289791 3.5974422e-17 # -0.0370582527 -2.17438821e-16 # -0.057632351 -6.36140996e-16 # -0.0914969318 -2.50523848e-16 # -0.10386823 2.2689425e-17 # -0.0909332183 -2.75034345e-16 # -0.0881315657 -2.82491927e-16 # -0.0976315833 -1.42172929e-16 # -0.116685574 2.70344127e-16 # -0.141716467 2.15573511e-16 # -0.173295533 -5.9850889e-17 # -0.218664133 -1.3467447e-16 # -0.249605394 -6.4103056e-17 # -0.253860842 4.7032768e-16 # -0.218680498 5.57609863e-16 # -0.131366224 4.65740468e-16 # -0.0476156066 2.18371877e-16 # END