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1 s suggested by accurately measured adiabatic ionization energies.
2 compared using both activation and carbon 1s ionization energies.
3 the hpp ligands largely accounts for the low ionization energies.
4 and tryptophan, this approach yields aqueous ionization energies (4.46 and 4.58 eV, respectively) in
6 nitio methodology to determine the adiabatic ionization energies (AIEs) of specific gas-phase cytosin
7 combination of DFT-calculated average local ionization energies (ALIEs), thermodynamics of the produ
9 oxidation of various systems using adiabatic ionization energies and electron affinities calculated f
12 chemical calculations are presented for the ionization energy and cation stability of several alkeny
15 s from the competition between trends in the ionization energy and the ion-substrate coupling, down t
16 the large difference between Ag(+) and Cu(+) ionization energies ( approximately 1.5 eV), which shoul
18 In aqueous solution, the base and phosphate ionization energies are more similar, and only differ by
19 in 2 dimensions and mass spectra at variable ionization energies are shown to give unparalleled power
25 ransfer such as the reorganization energies, ionization energies, charge-injection barriers, polariza
27 en the physical properties of a ligand, e.g. ionization energy, dipole moment, and polarizability, an
32 frameworks and apply it to obtain the first ionization energy for six prototype materials including
34 resonance energies, proton affinities, core ionization energies, frontier molecular orbitals, atomic
36 ction reaction efficiencies and the vertical ionization energies (IE) of the hydrogen-atom donors, bu
37 nization efficiencies was greatest when high ionization energy (IE) solvent compositions (IEs above 1
42 This was achieved by sublimation of a low ionization energy matrix compound, 1,5-diaminonapthalene
44 atmospheric aerosols are analyzed and their ionization energies measured with uncertainties of +/-60
45 ee energies of hydration to describe aqueous ionization energies of 2'-deoxythymidine 5'-phosphate (5
47 0.1 eV and further indicated that the lower ionization energies of clusters permitted their detectio
50 rained cyclic molecules to reduce the lowest ionization energies of sulfur, selenium, and tellurium c
53 al results provides indirectly the adiabatic ionization energies of the free phosphine ligands, P(CH(
54 tity and is poorly correlated with the third ionization energies of the isolated metals but is well c
55 e substituents have a large influence on the ionization energies of the nitroethylene derivatives.
58 CH(3)OO has been measured, and an adiabatic ionization energy of (10.33 +/- 0.05) eV was determined
60 culations, suggest a state-to-state vertical ionization energy of 11.70 +/- 0.05 eV between the C(3)(
61 t3)6 has a closed electronic shell and a low ionization energy of 4.74 eV, and the successive replace
63 tronic structure calculations determined the ionization energy of Br(2)Y to be ~8.3 +/- 0.1 eV and fu
66 +/- 2.8 kcal mol(-1)) was combined with the ionization energy of hydrogen (313.6 kcal mol(-1)) to af
68 emission temperatures (4,000-15,000 K); the ionization energy of O2 is more than twice its bond diss
69 cesium atom (which has the lowest gas-phase ionization energy of the elements) or of any other known
70 ation can be tuned to an energy close to the ionization energy of the sample molecules, thus minimizi
72 hich has been determined to have a gas-phase ionization energy (onset, 3.51 electron volts) lower tha
73 ate)4 paddlewheel structures show record low ionization energies (onsets at 3.4 to 3.5 eV) and very n
74 clusters to become electron donors with low ionization energies or electron acceptors with high elec
77 xyguanosine 5'-monophosphate at a much lower ionization energy than the other three mononucleotides.
78 The results show that the shift to lower ionization energy that is expected with this substitutio
80 ions show the correlation from the gas-phase ionization energies to the solution redox potentials and
82 n DNA depend on accurate values for vertical ionization energies (VIEs), reorganization energies, and
85 -dCMP- and 5'-dTMP-, a comparison of aqueous ionization energies with gas-phase ionization potentials
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