------------------------------------------------------------------------------- -- -- -- Experiment Source Code -- -- Delta NMR Experiment & Machine Control Interface -- -- -- -- Copyright (c) 2005 JEOL Ltd -- -- All Rights Reserved -- -- -- ------------------------------------------------------------------------------- -- HELP.eng: HETCOR with pmlg decoupling -- Category: solids, 2D, heteronuclear correlation header filename => "hetcor_cp-noe-2D"; sample_id => ""; comment => "HETCOR with pmlg decoupling"; process = "2d_solid_scale.list"; include "header_solid"; end header; instrument include "instrument_solid"; end instrument; acquisition x_domain => "Carbon13"; x_offset => 100[ppm]; x_sweep => 350[ppm]; x_points_input => 512; x_points =? if x_points_input/x_sweep < 50 [ms] then x_points_input else 2; scans => 8; x_prescans => 0; mod_return => 1; y_domain => "Proton"; y_offset => 14[ppm]; include "acquisition_solid"; end acquisition; pulse collect COMPLEX,OBS COMPLEX,IRR; initial_wait = 10.0[ms]; tauNOE => 0.5[s], help "NOE mixing time"; irr_domain = y_domain, help "decoupled nucleus"; irr_offset = y_offset, help "decoupler offset"; irr_width_90 => irr90, help "90deg pulse width for irr_amp_pulse"; irr_width_180 => irr_width_90*2; irr_amp_pulse => 100[%], 0[%]->100[%]:0.01[%], help "set ampliper for irr pulse"; irr_amp_cwdec => 60[%], 0[%]->100[%] : 0.01[%], help "amplitude of decoupling"; obs_width_90 => x90, help "90deg pulse width for obs_amp_pulse"; obs_width_180 => x90*2, help "180deg pulse width for obs_amp_pulse"; obs_amp_pulse => 100[%], 0[%]->100[%]:0.01[%], help "set ampliper for X pulse"; irr_width_lg90 => irr90, help "90deg pulse width for lg_amp"; irr_width_lg = irr_width_lg90 * 4 * SQRT(2) / SQRT(3); irr_amp_lg => 100[%], 0[%]->100[%]:0.01[%], help "set ampliper for PMLG"; PMLGn =? 3, help "PMLGn pulse divided into 3 steps"; irr_width_lg_element => irr_width_lg / PMLGn; irr_width_lg_e_round =? round(irr_width_lg_element / 5[ns]) * 5[ns]; bef_trig_1 = 2000[ns]; bef_trig_2 = 1500[ns]; t_trig = 1400[ns]; aft_trig = 1200[ns]; t_w = bef_trig_1 + bef_trig_2 + t_trig + aft_trig; y_Setup =? "#Setup Y Dimension#"; Scale_factor_y => 0.47, help "Theoretical Scaling Factor"; Scale_y_sweep = 1 / Scale_factor_y; lg_loop => 2, 0->100:1, help "loop number for PMLG"; cycle_time_y = (irr_width_lg_e_round * 2 * PMLGn + t_w) * 2 * lg_loop; y_sweep = 1/cycle_time_y; get_freq = "pulse_service::get_freq_value"; scaled_y_sweep =? y_sweep / scale_factor_y * (1[Mppm] / _get_freq( y_domain )); y_points => 64; acq_time_y =? y_points * cycle_time_y; CP_Setup =? "#Setup CP#"; include "cp_solid"; Dec_Setup =? "#Setup Decoupling#"; irr_dec_offset => 5[ppm], help "offset for decoupling"; include "dec_solid"; tri_domain = irr_domain; tri_offset = irr_dec_offset; Others_Setup =? "#Setup Others#"; relaxation_delay => 5[s], help"inter-pulse delay"; repetition_time =? relaxation_delay + x_acq_time,help"relaxation_delay+x_acq_time"; z_filter => 1[ms]; obs_atn => xatn, help "attenuator of x_pulse"; irr_atn => irratn, help "set attenuator for irr pulse"; irr_phs_prep = {{ 0, 0,90,90,180,180,270,270},{90,90,180,180,270,270,0,0}}.ystep(180%2); irr_phs_lg = { 0}; irr_phs_cp = {270,90,0,180,90,270,180,0}; obs_phs_cp = {270,270,180,180,90,90,0,0}; obs_phs_acq1 = {180,0,90,270,0,180,270,90}.ystep(180%2); obs_phs_flip = {0}; obs_phs_store = {180}; irr_phs_cwdec = {270,90,0,180,90,270,180,0}; irr_phs_dec = {0}; obs_phs_dec = {8(0)}; irr_phs_flip = {0,180,90,270,180,0,270,90}; obs_phs_read = {0,180,90,270,180,0,270,90}; obs_phs_acq2 = {0,0,90,90,180,180,270,270}.ystep(180%2); include "pulse_solid"; module_config = "solid_sample continuous_fid"; begin initial_wait; relaxation_delay; irr_width_90, (tri.gate, tri.phs.irr_phs_prep, tri.amp.irr_amp_pulse, tri.atn.irr_atn); parallel justify center loop ystep {0->512:1} times loop lg_loop times t_w; irr_width_lg_e_round, (irr.gate, irr.phs.irr_phs_lg+ 34.6, irr.amp.irr_amp_lg, irr.atn.irr_atn); irr_width_lg_e_round, (irr.gate, irr.phs.irr_phs_lg+103.9, irr.amp.irr_amp_lg, irr.atn.irr_atn); irr_width_lg_e_round, (irr.gate, irr.phs.irr_phs_lg+173.2, irr.amp.irr_amp_lg, irr.atn.irr_atn); irr_width_lg_e_round, (irr.gate, irr.phs.irr_phs_lg+353.2, irr.amp.irr_amp_lg, irr.atn.irr_atn); irr_width_lg_e_round, (irr.gate, irr.phs.irr_phs_lg+283.9, irr.amp.irr_amp_lg, irr.atn.irr_atn); irr_width_lg_e_round, (irr.gate, irr.phs.irr_phs_lg+214.6, irr.amp.irr_amp_lg, irr.atn.irr_atn); t_w; irr_width_lg_e_round, (irr.gate, irr.phs.irr_phs_lg+ 34.6+180, irr.amp.irr_amp_lg, irr.atn.irr_atn); irr_width_lg_e_round, (irr.gate, irr.phs.irr_phs_lg+103.9+180, irr.amp.irr_amp_lg, irr.atn.irr_atn); irr_width_lg_e_round, (irr.gate, irr.phs.irr_phs_lg+173.2+180, irr.amp.irr_amp_lg, irr.atn.irr_atn); irr_width_lg_e_round, (irr.gate, irr.phs.irr_phs_lg+353.2+180, irr.amp.irr_amp_lg, irr.atn.irr_atn); irr_width_lg_e_round, (irr.gate, irr.phs.irr_phs_lg+283.9+180, irr.amp.irr_amp_lg, irr.atn.irr_atn); irr_width_lg_e_round, (irr.gate, irr.phs.irr_phs_lg+214.6+180, irr.amp.irr_amp_lg, irr.atn.irr_atn); end loop; end loop; justify center obs_width_180, (OBS.GATE, OBS.PHS.obs_phs_dec, OBS.AMP.obs_amp_pulse, OBS.ATN.obs_atn); end parallel; contact_time, (tri.gate, tri.phs.irr_phs_cp, tri.shape.{irr_shape_cp,"tri"}, tri.atn.irr_atn, obs.gate, obs.phs.obs_phs_cp, obs.shape.{obs_shape_cp,"obs"}, obs.atn.obs_atn); on (tri.gate, tri.phs.irr_phs_cwdec, tri.amp.irr_amp_cwdec, tri.atn.irr_atn); acq( dead_time, delay, obs_phs_acq1 ); off (tri.gate); irr_width_90, (tri.gate, tri.phs.irr_phs_flip, tri.amp.irr_amp_pulse, tri.atn.irr_atn); obs_width_90, (OBS.GATE, OBS.PHS.obs_phs_flip, OBS.AMP.obs_amp_pulse, OBS.ATN.obs_atn); z_filter; obs_width_90, (OBS.GATE, OBS.PHS.obs_phs_store, OBS.AMP.obs_amp_pulse, OBS.ATN.obs_atn); tauNOE; obs_width_90, (OBS.GATE, OBS.PHS.obs_phs_read, OBS.AMP.obs_amp_pulse, OBS.ATN.obs_atn); on (tri.gate, tri.phs.irr_phs_dec,tri.amp.irr_amp_dec, tri.atn.irr_atn,tri.inline_noise.irr_noise); acq( dead_time, delay, obs_phs_acq2 ); off (tri.gate); end pulse;