| { |
| "global": { |
| "nAtoms": 4, |
| "i0_i": 100000.0, |
| "i0_f": 1457364.699840104, |
| "alpha_i": 62.0, |
| "alpha_f": 74.38768403212686, |
| "phi_i": 0.0, |
| "phi_f": 0.0, |
| "IPs": [ |
| 291.9686279296875, |
| 290.4575805664062, |
| 290.1923522949219, |
| 290.1376953125 |
| ] |
| }, |
| "peaks": [ |
| { |
| "cluster": 0, |
| "en_i": 284.2889189453125, |
| "en_f": 284.222412305534, |
| "den": -0.06650663977848126, |
| "wid_i": 0.2315428704023361, |
| "wid_f": 0.2918173142107404, |
| "dwid": 0.06027444380840433, |
| "amp_i": 0.01337517146021128, |
| "amp_f": 0.0138832714770868, |
| "damp": 0.0005081000168755193, |
| "theta_i": 0.0, |
| "theta_f": 0.0, |
| "mod_amp_f": 0.0, |
| "xx": 1.363144530586169e-08, |
| "yy": 1.363144530586169e-08, |
| "zz": 1.363144530586169e-08 |
| }, |
| { |
| "cluster": 1, |
| "en_i": 285.089333984375, |
| "en_f": 285.0620644079083, |
| "den": -0.0272695764667219, |
| "wid_i": 0.2283177077770233, |
| "wid_f": 0.2695731464892175, |
| "dwid": 0.0412554387121942, |
| "amp_i": 0.03431685641407967, |
| "amp_f": 0.02300393038712737, |
| "damp": -0.011312926026952302, |
| "theta_i": 0.0, |
| "theta_f": 0.0, |
| "mod_amp_f": 0.0, |
| "xx": 3.211399501878986e-08, |
| "yy": 3.211399501878986e-08, |
| "zz": 3.211399501878986e-08 |
| }, |
| { |
| "cluster": 2, |
| "en_i": 285.6496062011719, |
| "en_f": 285.5090533596822, |
| "den": -0.1405528414896935, |
| "wid_i": 0.2211116701364517, |
| "wid_f": 0.3348890425595399, |
| "dwid": 0.11377737242308819, |
| "amp_i": 0.02311520837247372, |
| "amp_f": 0.00716070666735173, |
| "damp": -0.01595450170512199, |
| "theta_i": 0.0, |
| "theta_f": 0.0, |
| "mod_amp_f": 0.0, |
| "xx": 2.923272290900059e-08, |
| "yy": 2.923272290900059e-08, |
| "zz": 2.923272290900059e-08 |
| }, |
| { |
| "cluster": 3, |
| "en_i": 286.3299345703125, |
| "en_f": 286.1021424892874, |
| "den": -0.2277920810250862, |
| "wid_i": 0.2360716164112091, |
| "wid_f": 0.3103997172662077, |
| "dwid": 0.07432810085499858, |
| "amp_i": 0.00310489721596241, |
| "amp_f": 0.004280683257862623, |
| "damp": 0.0011757860419002132, |
| "theta_i": 0.0, |
| "theta_f": 0.0, |
| "mod_amp_f": 0.0, |
| "xx": 2.226856476994499e-09, |
| "yy": 2.226856476994499e-09, |
| "zz": 2.226856476994499e-09 |
| }, |
| { |
| "cluster": 4, |
| "en_i": 286.7301420898438, |
| "en_f": 286.7441830877277, |
| "den": 0.014040997883910222, |
| "wid_i": 0.2128382474184036, |
| "wid_f": 0.290002406704125, |
| "dwid": 0.07716415928572143, |
| "amp_i": 0.01049377117305994, |
| "amp_f": 0.005267312232610525, |
| "damp": -0.005226458940449415, |
| "theta_i": 0.0, |
| "theta_f": 0.0, |
| "mod_amp_f": 0.0, |
| "xx": 1.073768896020511e-08, |
| "yy": 1.073768896020511e-08, |
| "zz": 1.073768896020511e-08 |
| }, |
| { |
| "cluster": 5, |
| "en_i": 287.1703581542969, |
| "en_f": 287.070122165176, |
| "den": -0.10023598912090392, |
| "wid_i": 0.226125180721283, |
| "wid_f": 0.2435953818726367, |
| "dwid": 0.017470201151353726, |
| "amp_i": 0.01318987086415291, |
| "amp_f": 0.00696743205209632, |
| "damp": -0.00622243881205659, |
| "theta_i": 0.0, |
| "theta_f": 0.0, |
| "mod_amp_f": 0.0, |
| "xx": 0.0005929034086875618, |
| "yy": 0.0005929034086875618, |
| "zz": 0.0005929034086875618 |
| }, |
| { |
| "cluster": 6, |
| "en_i": 287.5705656738281, |
| "en_f": 287.6100735456201, |
| "den": 0.039507871791954585, |
| "wid_i": 0.2261471003293991, |
| "wid_f": 0.255982734607496, |
| "dwid": 0.02983563427809688, |
| "amp_i": 0.006921455264091492, |
| "amp_f": 0.003789979257639446, |
| "damp": -0.0031314760064520457, |
| "theta_i": 0.0, |
| "theta_f": 0.0, |
| "mod_amp_f": 0.0, |
| "xx": 0.0004888346884399652, |
| "yy": 0.0004888346884399652, |
| "zz": 0.0004888346884399652 |
| }, |
| { |
| "cluster": 7, |
| "en_i": 288.130837890625, |
| "en_f": 288.1590572750983, |
| "den": 0.028219384473288756, |
| "wid_i": 0.2510377168655396, |
| "wid_f": 0.2753292502602343, |
| "dwid": 0.024291533394694698, |
| "amp_i": 0.007747238501906395, |
| "amp_f": 0.004559261917911513, |
| "damp": -0.0031879765839948823, |
| "theta_i": 0.0, |
| "theta_f": 0.0, |
| "mod_amp_f": 0.0, |
| "xx": 0.00052744330605492, |
| "yy": 0.00052744330605492, |
| "zz": 0.00052744330605492 |
| }, |
| { |
| "cluster": 8, |
| "en_i": 288.5310454101563, |
| "en_f": 288.5674085932232, |
| "den": 0.036363183066896454, |
| "wid_i": 0.233685776591301, |
| "wid_f": 0.2171902025324941, |
| "dwid": -0.01649557405880689, |
| "amp_i": 0.0005445049027912319, |
| "amp_f": 0.002079175800269716, |
| "damp": 0.001534670897478484, |
| "theta_i": 0.0, |
| "theta_f": 0.0, |
| "mod_amp_f": 0.0, |
| "xx": 0.000148188992170617, |
| "yy": 0.000148188992170617, |
| "zz": 0.000148188992170617 |
| }, |
| { |
| "cluster": 9, |
| "en_i": 288.8512053222656, |
| "en_f": 288.8701582893826, |
| "den": 0.018952967116945274, |
| "wid_i": 0.2167567312717438, |
| "wid_f": 0.2597398392706664, |
| "dwid": 0.042983107998922604, |
| "amp_i": 0.01666588708758354, |
| "amp_f": 0.006241813588937779, |
| "damp": -0.010424073498645759, |
| "theta_i": 0.0, |
| "theta_f": 0.0, |
| "mod_amp_f": 0.0, |
| "xx": 0.0002435458736727014, |
| "yy": 0.0002435458736727014, |
| "zz": 0.0002435458736727014 |
| }, |
| { |
| "cluster": 10, |
| "en_i": 289.5315336914063, |
| "en_f": 289.3790077531795, |
| "den": -0.15252593822680183, |
| "wid_i": 0.3004379868507385, |
| "wid_f": 0.3720181183022386, |
| "dwid": 0.07158013145150005, |
| "amp_i": 0.01831073872745037, |
| "amp_f": 0.008025883086693778, |
| "damp": -0.010284855640756593, |
| "theta_i": 0.0, |
| "theta_f": 0.0, |
| "mod_amp_f": 0.0, |
| "xx": 0.0008077434031292796, |
| "yy": 0.0008077434031292796, |
| "zz": 0.0008077434031292796 |
| }, |
| { |
| "cluster": 11, |
| "en_i": 290.73215625, |
| "en_f": 290.2057452175986, |
| "den": -0.5264110324014268, |
| "wid_i": 0.4348386526107788, |
| "wid_f": 0.4605582579141879, |
| "dwid": 0.02571960530340911, |
| "amp_i": 0.0212064366787672, |
| "amp_f": 0.01140109864735541, |
| "damp": -0.00980533803141179, |
| "theta_i": 0.0, |
| "theta_f": 0.0, |
| "mod_amp_f": 0.0, |
| "xx": 0.001644658157601953, |
| "yy": 0.001644658157601953, |
| "zz": 0.001644658157601953 |
| }, |
| { |
| "cluster": 12, |
| "en_i": 292.0528044433594, |
| "en_f": 291.7493394937028, |
| "den": -0.3034649496565862, |
| "wid_i": 0.8004195690155029, |
| "wid_f": 0.8602201534126902, |
| "dwid": 0.05980058439718727, |
| "amp_i": 0.01832721382379532, |
| "amp_f": 0.01161725804006913, |
| "damp": -0.006709955783726188, |
| "theta_i": 0.0, |
| "theta_f": 0.0, |
| "mod_amp_f": 0.0, |
| "xx": 0.01680596917867661, |
| "yy": 0.01680596917867661, |
| "zz": 0.01680596917867661 |
| }, |
| { |
| "cluster": 13, |
| "en_i": 293.6536040039063, |
| "en_f": 293.4986325825828, |
| "den": -0.15497142132352337, |
| "wid_i": 0.9840633869171143, |
| "wid_f": 1.089980355415895, |
| "dwid": 0.10591696849878085, |
| "amp_i": 0.02536464482545853, |
| "amp_f": 0.01248776302117517, |
| "damp": -0.01287688180428336, |
| "theta_i": 0.0, |
| "theta_f": 0.0, |
| "mod_amp_f": 0.0, |
| "xx": 0.02857760526239872, |
| "yy": 0.02857760526239872, |
| "zz": 0.02857760526239872 |
| }, |
| { |
| "cluster": 14, |
| "en_i": 295.6946196289063, |
| "en_f": 295.3694532386581, |
| "den": -0.3251663902482278, |
| "wid_i": 1.325883746147156, |
| "wid_f": 1.337760153353884, |
| "dwid": 0.011876407206728112, |
| "amp_i": 0.01201002206653357, |
| "amp_f": 0.01298727907447044, |
| "damp": 0.0009772570079368686, |
| "theta_i": 0.0, |
| "theta_f": 0.0, |
| "mod_amp_f": 0.0, |
| "xx": 0.01592052727937698, |
| "yy": 0.01592052727937698, |
| "zz": 0.01592052727937698 |
| }, |
| { |
| "cluster": 15, |
| "en_i": 298.4960112304688, |
| "en_f": 298.5192649546011, |
| "den": 0.023253724132302978, |
| "wid_i": 2.14324688911438, |
| "wid_f": 2.13684538026393, |
| "dwid": -0.006401508850450099, |
| "amp_i": 0.02229846082627773, |
| "amp_f": 0.02356569057158224, |
| "damp": 0.0012672297453045107, |
| "theta_i": 0.0, |
| "theta_f": 0.0, |
| "mod_amp_f": 0.0, |
| "xx": 0.05276388674974442, |
| "yy": 0.05276388674974442, |
| "zz": 0.05276388674974442 |
| }, |
| { |
| "cluster": 16, |
| "en_i": 303.498513671875, |
| "en_f": 303.1595681800692, |
| "den": -0.33894549180581635, |
| "wid_i": 2.83004355430603, |
| "wid_f": 2.810330239490249, |
| "dwid": -0.01971331481578087, |
| "amp_i": 0.01947483606636524, |
| "amp_f": 0.03065185441589805, |
| "damp": 0.011177018349532813, |
| "theta_i": 0.0, |
| "theta_f": 0.0, |
| "mod_amp_f": 0.0, |
| "xx": 0.04694091901183128, |
| "yy": 0.04694091901183128, |
| "zz": 0.04694091901183128 |
| }, |
| { |
| "cluster": 17, |
| "en_i": 307.5805754394531, |
| "en_f": 307.1555052869514, |
| "den": -0.4250701525017462, |
| "wid_i": 3.598230123519897, |
| "wid_f": 3.255359412071909, |
| "dwid": -0.3428707114479881, |
| "amp_i": 0.005401517264544964, |
| "amp_f": 0.01334540372291874, |
| "damp": 0.007943886458373775, |
| "theta_i": 0.0, |
| "theta_f": 0.0, |
| "mod_amp_f": 0.0, |
| "xx": 0.02942488715052605, |
| "yy": 0.02942488715052605, |
| "zz": 0.02942488715052605 |
| }, |
| { |
| "cluster": 18, |
| "en_i": 314.4639982910156, |
| "en_f": 313.4989286060409, |
| "den": -0.9650696849747078, |
| "wid_i": 4.86261510848999, |
| "wid_f": 3.924063784253469, |
| "dwid": -0.9385513242365211, |
| "amp_i": 0.01569372043013573, |
| "amp_f": 0.007284100996848809, |
| "damp": -0.00840961943328692, |
| "theta_i": 0.0, |
| "theta_f": 0.0, |
| "mod_amp_f": 0.0, |
| "xx": 0.04018429666757584, |
| "yy": 0.04018429666757584, |
| "zz": 0.04018429666757584 |
| } |
| ] |
| } |
|
|
