HBr

Relevant to the HBr-FvsV state paper:

https://notendur.hi.is/agust/rannsoknir/rempi/hbr/Jan12/PPT-130212ak.ppt https://notendur.hi.is/agust/rannsoknir/rempi/hbr/Jan12/XLS-130212ak.xlshttps://notendur.hi.is/jil3/work/Paper/HBr_FvsV/BWs%20for%20HBr_FvsV.xlsx

Model:

E1

H0

V7 F1

1/E1

1/other

1/H0

1/E1

1/H0

1/F1 1/F1

otherHFEV 11111

0117

000

011

011

11;

11;

11

HHFFEE Assume:

0117

11111

HFEVother

Linewidths

https://notendur.hi.is/jil3/work/Paper/HBr_FvsV/BWs%20for%20HBr_FvsV.xlsx

Bw vs lifetime comparisons 79

J´=6 J´=6 J´=3

states: Bw/cm-1 t(ps)= 1/t (ps-1)

rate const. Sums fraction Bw/cm-1 0t(ps)= 1/t (ps-1)

rate const. Sums fraction

V7 7.80613 ca. 0.678954 1.472855 1.472855V7 1 4.26927 1.24143 0.805523 0.805523 1?

E1 4.73001> 1.120505 0.892455 0.605935 3.87256 1.368604 0.730672 0.907078?

F1 1.4125>> 3.752212 0.266509 0.180948 1.00749 5.260598 0.190092 0.235986?

H0 1.23787 >> 4.281548 0.23356 1.392525E1+F1+H0 0.158577 1.4125 3.752212 0.266509 1.187274 0.330853?

diff/others: 12.44862 0.08033 0.08033 0.05454 -0.38175 0?

J´=5(?) J´=4

V7 8guess! 0.6625 1.509434 1.509434 1 7.6149 0.696004 1.436774 1.436774 1

E1 4.87403 1.087396 0.919628 0.609254 4.68442 1.13141 0.883853 0.615165

F1 1.44447 3.669166 0.272542 0.180559 1.18607 4.468539 0.223787 0.155756

H0 1.12631 4.705632 0.212511 1.404681 0.140789 1.16461 4.55088 0.219738 1.327377 0.152938

diff/others: 9.546281 0.104753 0.104753 0.069399 9.141083 0.109396 0.109396 0.07614

https://notendur.hi.is/agust/rannsoknir/rempi/hbr/Jan12/XLS-130212ak.xls

Bw vs lifetime comparisons 81

J´=6 J´=6 J´=3

states: Bw/cm-1 t(ps)= 1/t (ps-1)

rate const. Sums fraction Bw/cm-1 0t(ps)= 1/t (ps-1)

rate const. Sums fraction

V7 7.80613 ca. 0.678954 1.472855 1.472855V7 1? 4.26927 1.24143 0.805523 0.805523 1?

E1 3.30123> 1.605462 0.622874 0.422902? 3.76181 1.408896 0.709775 0.881137?

F1 1.58492 >> 3.344017 0.299042 0.203035? 1.31921 4.017556 0.248908 0.309001?

H0 1.35547 >> 3.910083 0.255749 1.177664E1+F1+H0 0.173642? 1.39211 3.80717 0.262662 1.221345 0.326077?

diff/others: 3.387642 0.295191 0.295191 0.200421? -0.41582 0?

J´=5(?) J´=4

V7 8.525guess! 0.621701 1.608491 1.608491 1 7.6149 0.696004 1.436774 1.436774 1

E1 4.97777 1.064734 0.939202 0.583903 3.94064 1.344959 0.743517 0.517491

F1 2.32178 2.282731 0.438072 0.27235 1.70066 3.116437 0.320879 0.223333

H0 1.22425 4.329181 0.230991 1.608264 0.143607 1.25774 4.213907 0.237309 1.301706 0.165168

diff/others: 4416.667 0.000226 0.000226 0.000141 7.403682 0.135068 0.135068 0.094008

https://notendur.hi.is/agust/rannsoknir/rempi/hbr/Jan12/XLS-130212ak.xls

In summary: according to J´=4 and 6: i = 79 & 81 : rates ca.

E1

H0

V7 F1

1/H0

1/tV7 = 1.47 ps-1

1/F1

1/E1

1/H0

=0.23 ps-1

1/E1 = 0.83 ps-1

1/F1

=0.27

1/other

=0.11 ps-1

In summary: according to J´=4 and 6: i = 79& 81 : fractional rates ca.:

E1

H0

V7 F1

1/H0

Rel. 1/tV7 = 1

1/F1

1/E1

Rel. 1/E1 = 0.58

Rel.1/H0

=0.16

Rel. 1/F1

=0.19

1/other

=0.07