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Calculated Adiabatic Ionization Energies

Species Name
H Hydrogen atom
D Deuterium atom
He Helium atom
H2 Hydrogen diatomic
HeH Helium hydride
Li Lithium atom
Be Beryllium atom
B Boron atom
C Carbon atom
N Nitrogen atom
O Oxygen atom
F Fluorine atom
Ne Neon atom
Na Sodium atom
Mg Magnesium atom
Al Aluminum atom
Si Silicon atom
P Phosphorus atom
S Sulfur atom
Cl Chlorine atom
Ar Argon atom
K Potassium atom
Ca Calcium atom
Sc Scandium atom
Ti Titanium atom
V Vanadium atom
Cu Copper atom
Zn Zinc atom
Ga Gallium atom
Ge Germanium atom
As Arsenic atomic
Se Selenium atom
Br Bromine atom
Kr Krypton atom
I Iodine atom
LiH Lithium Hydride
BeH beryllium monohydride
BH Boron monohydride
CH Methylidyne
NH Imidogen
OH Hydroxyl radical
HF Hydrogen fluoride
NeH neon hydrogen
NaH sodium hydride
MgH magnesium monohydride
AlH aluminum monohydride
SiH Silylidyne
PH phosphorus monohydride
HS Mercapto radical
HCl Hydrogen chloride
KH Potassium hydride
CaH Calcium monohydride
ScH Scandium monohydride
CrH Chromium hydride
ZnH Zinc monohydride
GaH Gallium monohydride
GeH germylidene
AsH Arsenic monohydride
HSe Selenium monohydride
HBr hydrogen bromide
HI Hydrogen iodide
BeH2 beryllium dihydride
BH2 boron dihydride
CH2 Methylene
NH2 Amino radical
H2O Water
AlH2 aluminum dihydride
SiH2 silicon dihydride
PH2 Phosphino radical
H2S Hydrogen sulfide
AsH2 Arsenic dihydride
H2Se Hydrogen selenide
BH3 boron trihydride
CH3 Methyl radical
NH3 Ammonia
AlH3 aluminum trihydride
SiH3 Silyl radical
PH3 Phosphine
GeH3 Germyl radical
AsH3 Arsine
CH4 Methane
NH4 Ammonium radical
SiH4 Silane
PH4 Phosphoranyl radical
Li2 Lithium diatomic
Be2 Beryllium diatomic
B2 Boron diatomic
BC boron monocarbide
C2 Carbon diatomic
BN boron nitride
LiN Lithium Nitride
BeN Beryllium mononitride
N2 Nitrogen diatomic
CN Cyano radical
CO Carbon monoxide
BeO beryllium oxide
O2 Oxygen diatomic
NO Nitric oxide
LiO lithium oxide
BO boron monoxide
BeF Beryllium monofluoride
BF Boron monofluoride
FO Oxygen monofluoride
NF nitrogen fluoride
LiF lithium fluoride
F2 Fluorine diatomic
CF Fluoromethylidyne
Ne2 Neon diatomic
NaLi lithium sodium
Na2 Sodium diatomic
NaO sodium monoxide
NaF sodium fluoride
Mg2 Magnesium diatomic
MgO magnesium oxide
MgF Magnesium monofluoride
Al2 Aluminum diatomic
AlN Aluminum nitride
AlO Aluminum monoxide
AlF Aluminum monofluoride
Si2 Silicon diatomic
SiC silicon monocarbide
SiN Silicon nitride
SiO Silicon monoxide
SiF silicon monofluoride
P2 Phosphorus diatomic
SiP Silicon monophosphide
CP Carbon monophosphide
PN Phosphorus mononitride
PO Phosphorus monoxide
PF phosphorus monofluoride
S2 Sulfur diatomic
SO Sulfur monoxide
LiS Lithium monosulfide
SiS silicon monosulfide
BeS beryllium sulfide
BS boron sulfide
AlS Aluminum sulfide
PS phosphorus sulfide
NS Mononitrogen monosulfide
MgS magnesium sulfide
CS carbon monosulfide
SF Monosulfur monofluoride
PCl phosphorus chloride
BCl boron monochloride
SiCl Clorosilylidyne
MgCl magnesium monochloride
ClO Monochlorine monoxide
SCl sulfur monochloride
NCl nitrogen monochloride
AlCl Aluminum monochloride
BeCl beryllium monochloride
NaCl Sodium Chloride
ClF Chlorine monofluoride
Cl2 Chlorine diatomic
CCl carbon monochloride
LiCl lithium chloride
Ar2 Argon diatomic
NaK Sodium Potassium
KO Potassium monoxide
ZnF Zinc monofluoride
GaF Gallium monofluoride
GaCl Gallium monochloride
GeO Germanium monoxide
GeF Germanium monofluoride
GeCl Germanium monochloride
Se2 Selenium diatomic
SiSe Silicon Monoselenide
SeO Selenium monoxide
CSe Carbon monoselenide
SeS Selenium monosulfide
Br2 Bromine diatomic
NaBr Sodium Bromide
LiBr Lithium Bromide
BrCl Bromine monochloride
BrF Bromine monofluoride
SiBr Silicon monobromide
I2 Iodine diatomic
C2H Ethynyl radical
HCN Hydrogen cyanide
HNC hydrogen isocyanide
NNH Dinitrogen monohydride
COH Hydroxymethylidyne
NOH NOH
HNO Nitrosyl hydride
HO2 Hydroperoxy radical
HCO Formyl radical
HPO HPO
SOH Sulfur Hydroxide
HCS Thioformyl radical
HOCl hypochlorous acid
HOBr Hypobromous acid
C2H2 Acetylene
H2CN H2CN
CNH2 CNH2
HCNH HCNH
N2H2 (E)-diazine
H2CO Formaldehyde
H2O2 Hydrogen peroxide
CH2F fluoromethyl radical
H2CS Thioformaldehyde
H2S2 Disulfane
CH2Cl chloromethyl radical
C2H3 vinyl
CH2NH Methanimine
CHNH2 aminomethylene
CH3O Methoxy radical
CH2OH Hydroxymethyl radical
NH2OH hydroxylamine
CH3F Methyl fluoride
CH3Cl Methyl chloride
C2H4 Ethylene
N2H4 Hydrazine
CH3OH Methyl alcohol
CH3SH Methanethiol
C2H5 Ethyl radical
CH3NH2 methyl amine
B2H6 Diborane
C2H6 Ethane
CH3NH3 methyl ammonium radical
Li3 Lithium trimer
C3 carbon trimer
N3 azide radical
Li2O dilithium oxide
N2O Nitrous oxide
O3 Ozone
NO2 Nitrogen dioxide
BO2 Boron dioxide
CO2 Carbon dioxide
CF2 Difluoromethylene
FCO Carbonyl fluoride
NF2 Difluoroamino radical
SiF2 Silicon difluoride
PO2 Phosphorus dioxide
PF2 Phosphorus difluoride
S3 Sulfur trimer
OCS Carbonyl sulfide
CS2 Carbon disulfide
SO2 Sulfur dioxide
SF2 sulfur difluoride
OClO Chlorine dioxide
ClOO chloroperoxy radical
CCl2 dichloromethylene
SeO2 Selenium dioxide
HN3 hydrogen azide
HNNO nitrosoazane
HNO2 Nitrous acid
HOCO Hydrocarboxyl radical
CHF2 difluoromethyl radical
HCCF Fluoroacetylene
HFCO formyl fluoride
CHCl2 dichloromethyl radical
CHFCl Chlorofluoromethyl radical
H2COO Dioxymethyl radical
CH2CO Ketene
C3H3 Propargyl radical
C3H3 cyclopropenyl radical
CHNCH2 2H-Azirine
CH3CN Acetonitrile
CH3CO Acetyl radical
CH3OO methylperoxy radical
CH2CHF Ethene, fluoro-
CH3CHO Acetaldehyde
C2H4O Ethylene oxide
C3H5 Allyl radical
CH3CHOH 1-hydroxy-ethyl radical
CH3SCH3 Dimethyl sulfide
CH3CHCH3 Isopropyl radical
C3H7 n-Propyl radical
C4 Carbon tetramer
C2N2 Cyanogen
NO3 Nitrogen trioxide
CF2O Carbonic difluoride
CF3 Trifluoromethyl radical
NF3 Nitrogen trifluoride
BF3 Borane, trifluoro-
SiF3 Silicon trifluoride radical
SO3 Sulfur trioxide
C2Cl2 dichloroacetylene
CCl3 Trichloromethyl radical
SiCl3 trichlorosilyl radical
HCCCN Cyanoacetylene
C4H2 Diacetylene
C2H2O2 Ethanedial
C3H3N acrylonitrile
NH2CONH2 Urea
C3O2 Carbon suboxide
CCl4 Carbon tetrachloride
C2HF3 Trifluoroethylene
C4H4O Furan
C4H10O 1-Butanol
C2F4 Tetrafluoroethylene
CF3CN Acetonitrile, trifluoro-
SF5 Sulfur pentafluoride
C6H6 Benzene
C7H7 cycloheptatrienyl radical