List keywords from the reference database

-binaphthyl-2 1	-dithiol 1	1 1
1′ 1	14N 1	16O3 1
18O3 1	1H 1	2′ 1
2-Pyrone 1	2E state 1	3 1
31P 1	31P hyperfine coupling 1	3D oxalate networks 1
3D-QSAR 1	3MLCT 1	4 14-Dimethycholestane 1
5-Di(trifluoromethyl)acetophenone 1	⁵⁷Fe Mössbauer spectroscopy 1	[Co(bpy)3]2+ 1
[Cr(bpy)3]3+ 2	[Cr(ox)3]3− 1	[Cr(ox)3]3- 1
[Cr(ox)3]3– 1	[Fe(bpy)3]2+ 1	[Fe(ptz)6](BF4)2 1
[Ru(bpy)3]2+ 1	Ab initio calculation 1	ab initio calculations 4
ab initio free energies 1	absorption spectra 1	Acid effect 1
Activated ketones 1	activation energy 1	Adsorption 1
Ag+ 1	Alanates 1	alkali metals 1
Alkaline earth fluorides 1	alkaline earth metals 1	alkaline earths 1
Alkanes 1	Alkenes 1	Alkynes 1
AMDIS 1	aminoxyls 1	ammonium 1
amphiphiles 1	amphiphilic brushes 1	anisotropic ligand fields 1
annulenes 1	anomeric 1	anoxic water 1
application 1	arenes 1	argentophilic interactions 1
aromatic compounds 1	aromaticity 4	aromatics 1
artemisinin 1	astrochemistry 1	Asymmetric 1
Asymmetric heterogeneous catalysis 1	Asymmetric hydrogenation 1	asymmetric synthesis 1
atom transfer radical polymerization (ATRP) 1	atom-molecule reactions 1	attenuated total reflection 2
azides 1	Ba12F19Cl5 1	Ba2Mg3F10 1
BaFBr 1	BaMgF4:Eu 1	barium 1
Barium fluorides 1	barium halides 2	barium strontium fluorohalides 1
Bariumfluorochloride 1	basis set 1	basis sets 1
binary compounds 1	BINDING 1	Binding assays 1
biogenic methane 1	biomimetic 1	biomimetic membrane 1
bis-iminophosphoranes 1	bistability 1	block copolymers 1
blue phosphor 1	bond theory 1	bonding 1
borohydrides 4	boron 1	BSA adsorption 1
CaF2 1	calcium 1	calcium borohydride 1
Calciumfluoride: Samarium 1	capillary electrophoresis 1	carbenium ions 1
CASPT2 1	catalyst 2	cation radical 1
cationic surfactant 1	cetylpyridinium bromide 1	charge exchange 1
charge transfer 6	Chemical composition 1	chemical potential 1
chemical pressure 2	chemical reactions 1	chemical shift 1
chemical shifts 1	chemisorption 3	Chiral polymers 1
chiral resolution 1	chiral surfaces 2	chirality 2
chromium complexes 1	chromium(III)-tris-oxalate 1	Cinchonidine 2
Cinchonine 1	circular dichroism 3	classical Coulomb energy 1
cluster 1	cluster calculations 1	cluster compounds 1
co oxidation 1	cobalt 2	Color center absorption bands 1
coloring strength 1	comets: general 1	comparative evaluations 1
computational chemistry 3	computer simulations 1	condensed matter 1
conducting materials 1	configuration interactions 2	configurational coordinate 1
conformation 2	conformers 1	cooperative effects 3
cooperativity 1	coordination bond 1	coordination chemistry 1
coordination modes 1	copper 1	copper peroxide 1
copper superoxide 1	correlation 1	COST 1
coupled cluster calculations 1	creatine kinase 1	crown ethers 1
cryptands 1	crystal and ligand fields 1	crystal Field 2
crystal fields 1	crystal growth 4	crystal structure 14
crystal structures 1	cyanide bridging ligand 1	cyclic trimers 1
Cyclic voltammetry 3	cyclometallated ligand complexes 1	deconvolution 1
delocalization 2	denaturation 1	dendrimers 1
density functional 1	density functional calculations 12	density functional method 1
density functional theory 21	DFT 6	DFT calculations 3
dielectric properties 1	diffraction 1	dinuclear complexes 1
Dioxygen sensors 1	disorder 1	disordered crystals 1
disordered solids 1	disordered structure 1	dissociation energies 1
domain effects 1	donor-acceptor systems 5	Donoreacceptor systems 1
Donor–acceptor compound 1	doping 1	DTA 1
dust 1	eigenvalues and eigenfunctions 1	elasticity 1
electrical conductivity 1	electrochemistry 1	electron correlations 1
electron delocalization 1	electron density 1	Electron energy loss spectroscopy (EELS) 1
electron localization function 1	electron spin resonance 1	electron transfer 3
Electronic spectroscopy 1	electronic states 1	electronic structure 1
electrostatic potentials 1	elpasolite 1	embedding 4
embedding potential 2	enantiodiscrimination 1	Enantioselective hydrogenation 2
enantioselectivity 1	energy conversion 1	energy migration 1
energy transfer 2	enzyme 1	enzyme models 1
EPR 5	EPR and optical spectroscopy 1	EPR spectroscopy 6
ESCHERICHIA-COLI 1	ESR 1	Ethers of cinchonidine 1
ethyl pyruvate 1	Europium 2	Europium fluorides 1
Exchange interaction 1	exchange-correlation functional 1	exchange-energy functional 1
excitation energy hopping 1	excitation energy transfer 1	excited states 1
Experimental study 2	external pressure 1	extinction 1
f-f transitions 1	fas-solid interface 1	Fe(II) compunds 1
femtochemistry 1	ferroelectric monodomains 1	fluorescence 1
fluorescence line narrowing 2	fluorescent materials 1	fluorescent probes 1
fluoride 1	fluorides 5	fluoro-halides 1
fluorohalides 2	flux and solid state synthesis 1	fluxes 1
fluxionality 1	four electron systems 1	Fourier transform spectroscopy 1
fragmentation reaction 1	framework materials 1	frozen density functional theory (FDFT) 1
fullerenes 1	Functional coupling 1	f–f transitions 1
Förster transfer 1	gadolinium 1	galactose oxidase 1
GC-CMS 1	general studies of phase transitions 1	gold 4
gold nanoparticles 1	guest host interaction 1	HAMSTER OVARY CELLS 1
helical cation 1	helical structures 5	helicates 1
helicenes 1	heme 1	HEPT 1
heterobimetallic complexes 1	heterocycles 1	heterodinuclear complexes 1
Hexagonal Crystal Structure 1	HF calculations 1	high energy density material 1
high energy density material (HEDM) 1	high pressure 2	high pressure luminescence 1
high pressures 1	high spin-low spin relaxation 1	high-resolution spectroscopy 1
high-spin->low-spin relaxation 1	high-spin->ow-spin relaxation 1	high-spin<->low-spin relaxation 1
historical aspects 1	HIV 1	hole burning 1
host-guest systems 2	hybrid quantum mechanical/molecular mechanics (QM/MM) approaches 1	hydrides 5
hydrogen 1	hydrogen absorbing materials 1	hydrogen bonding 2
hydrogen bonds 1	hydrogen neutral atoms 1	hydrogen neutral molecules 1
Hydrogen storage 5	Hydrogen storage material 1	hydrogen storage materials 5
hydrogen transfer 2	hydrogen-bonded complexes 1	Hydrogenation 2
hydrolysis 1	hyperconjugation 1	hyperfine structure 1
hyperpolarizability 1	hysteresis 2	impurity absorption spectra 1
in situ experiments 1	in situ spectroscopy 3	in situ XANES 1
Inelastic X-ray scattering 1	infrared and Raman spectroscopy 2	inorganic cluster 1
inorganic compounds 5	inorganic hybrid composites 1	inorganic synthesis 2
instability 1	insulators 1	intermetallic compound 1
intermolecular interactions 2	internal rotation 1	interstellar hydroxylamine chemistry 1
intersystem crossing 3	Intra cavity laser absorption spectroscopy (ICLAS) 1	Inversion of enantioselectivity 1
ion pairs 1	Ion substitution 1	IR 1
IR frequency shifts 1	IR spectra 1	IR spectroscopy 3
iron 3	iron complexes 3	iron(II) complex 1
Iron(II) complexes 2	iron(II) coordination compounds 2	ISM: molecules 1
isomerization 2	Jahn-Teller distortion 1	Jahn-Teller effect 1
Jahn-Teller effects 1	Ketopantolactone 1	kinetic energy functional 5
kinetic-energy functional 1	kinetics 1	KSCED 1
L-Proline 1	lake Lugano methane 1	lanthanide 2
lanthanides 5	laser 1	laser photoexcitation 1
laser spectroscopy 1	lattice vibrations 1	lead halides 1
LIESST 2	LIESST effect 1	ligand field theory 1
ligand-field 1	ligand-field theory 1	light induced thermal hysteresis 1
lipid bilayer 1	liquid crystals 2	liquid-crystals 1
lithium sulfides 1	Londo-Hückel 1	low index single crystal surfaces 1
Low Temperature Gel Method 1	luminescence 14	Luminescence spectroscopy 1
luminescent materials 1	macrocyclic ligands 1	magnesium 1
Magnesium fluorides 1	magnetic impurities 1	magnetic phase transition 1
magnetic properties 4	magnetism 1	magnetization curves 1
main group elements 1	malaria 1	malonic acid 1
manganese complexes 2	manganese compounds 1	Manuka honey 1
matrix decomposition 1	matrix isolation 1	MBE 1
Mechanism 1	mechanoelastic model 1	membranes 1
metal 1	metal hydrides 2	metal interactions 1
metal-metal interactions 1	metallacycles 1	metalloenzyme catalyzed reaction 1
metallomesogens 1	metastable states 1	metathesis 3
methods: laboratory 1	mixed-valent compounds 1	models of surface chemical reactions 1
Modifier conformation 1	modulation excitation spectroscopy 1	molecular beam deposition 1
molecular data 1	molecular dynamics 3	molecular dynamics method 1
molecular electronic states 1	molecular magnetism 1	molecular mechanics 1
Monte Carlo methods 1	Monterey 1	multi-level 1
multichromophoric systems 1	multiconfigurational SCF theory 1	multiplet structure 1
Mutagenesis 1	N ligands 4	N-hydroxyamino 1
N8 isomers 1	nanoarchitecture 1	nanocrystals 1
nanographene 1	nanoparticles 4	nanorods 1
nanostructures 1	Naphthopyranone 1	near infrared luminescence 1
Near-IR luminescence 1	neural network 1	neutron diffraction 2
nickel 2	nitrate reductase 1	nitrogen clusters 1
nitrogen heterocycles 2	NOE 1	non-covalent interactions 1
nonadiabatic multiphonon relaxation 1	one-dimensional polymer structures 1	ONIOM 1
optical activity 1	optical centre 1	optical hole burning 1
optical materials 1	optical properties 2	optical spectrometers 1
optical spectroscopy 1	optical studies 1	Optically active materials 1
orbital-free embedding 5	orbital-free theories 1	orbitals 1
organic 1	organic compounds 3	organometallic complexes 1
organometallic compounds 1	oxalate networks 2	Ozone 1
P ligands 2	Palladium 1	palladium complexes 1
PEPTIDES 1	persistent spectral hole burning 1	perturbation theory 3
phase transition 2	phase transitions 1	phenol 1
phonon-assisted energy transfer 1	Phonons 1	phosphaalkene 2
phosphaallenes 1	phosphaallylic radical 1	phosphinines 1
phosphorus 2	photocatalysis 2	photochemistry 4
photodegradation 1	Photodynamic therapy 1	photography 1
photoinduced electron transfer 2	photoluminescence 1	photomagnetism 1
photophysical effects 1	photophysical properties 3	photophysics 2
photostability 1	Photostimulated luminescence 1	photosynthesis 1
photovoltaics 1	phthalocynanines 1	Physical adsorption 1
physics computing 1	physisorption 2	Platinum 2
pm-irras 1	point defects 1	polarized Raman 1
polycyclic aromatic hydrocarbons 1	polymers 1	polymers (inorganic) 1
polymorphism 1	polynuclear complexes 2	Polypyridyl ligands 1
Polysiloxanes 1	porosity 1	porphycenes 2
positive ions 1	PROTEIN 1	protein structure 1
proton conductors 1	proton transfer 2	protonation 1
Prussian blue analogue 1	ps range 1	Pt/Al2O3 1
pulsed laser deposition 1	quantification of aromaticity based on theoretical NMR calculations 1	quantification of aromaticity in a Diels-Alder reaction path using NMR calculations 1
quantum chemical calculations 1	quantum chemical method 1	quantum chemistry 1
radiation chemistry 1	radiationless deactivation 1	radical anion 3
radicals 4	Raman 2	Raman and infrared spectroscopy 1
Raman spectroscopy 8	Rare earth compounds 1	rare-earth doped materials 1
rare-earth elements 1	reaction mechanisms 1	reactive ball milling 1
rearrangements 1	redox chemistry 3	regioselectivity 1
resonant and phonon-assisted excitation energy migration 1	resonant energy transfer 1	reverse transcriptase 1
Ring-substituted acetophenones 1	ruthenium 2	ruthenium complexes 2
Ruthenium(II) complex 1	Ruthenium(II) complexes 1	S ligands 1
samarium 5	sams 1	scaffolds 1
scaling relations 1	SCF calculations 3	self-assembly 5
self-organization in macromolecules 1	Semliki Forest virus system 1	sensors 1
silica 1	silico-aluminate 1	silicon 1
silver 1	single exponential decay detector 1	site-directed 1
size separation 1	Sm2+ 1	sodium compounds 1
solid phase microextraction 1	solid phase synthesis 1	solid solution stabilized compound 1
solid solutions 1	solid state structure 1	solid-gas interfaces 1
solutes 1	solution growth 1	solvatation 1
solvation 1	solvation dynamics 1	solvent effects 2
solvent-responsive behavior 1	spectral diffusion 2	spectral hole burning 1
spectral line breadth 1	spectroscopy 1	spectrum assignment 1
spin crossover 12	spin delocalization 1	spin dynamics 1
spin labeling 1	spin transition 1	spin-crossover 3
spin-transition 1	spin-transition solid 1	SrF2 1
SrFBr 1	stereoelectronic 1	stereoelectronic effects 1
stereoselectivity 1	Storage phosphor 1	strong vibronic coupling limit 1
strontium compounds 1	structural changes 1	structure elucidation 3
structure refinement 1	SUBSTANCE-P 1	subsystem quantum mechanics 1
subsystems 1	supramolecular chemistry 1	supramolecular materials 1
Surface chemical reaction 1	surface-initiated ATRP 1	synchrotron radiation 1
synchrotron X-ray diffraction 1	Synthesis 1	synthetic methods 1
Tachykinin NK1 receptor 1	tautomerism 2	TD-DFT 1
TDDFT 1	TDDFT calculations 1	tensors 1
ternary metal hydrides 1	tetrathiafulvalene 3	tetrathiafulvalenes 2
tetrazoles 2	theoretical 13C NMR calculation 1	theoretical calculations 1
theoretical NMR calculations 1	theoretical study 1	thermal stability 1
thermal and light-induced spin crossover 1	thermal desorption 1	thermodynamic properties 1
thermodynamics 2	thin films 2	time delay 1
time resolution 1	time-resolved anisotropy 1	time-resolved spectroscopy 2
TiO2 2	total energy bifunctional 1	transient absorption 2
transition metal 1	transition metal compounds 1	transition moments 1
transition states 3	triazaphenalene 1	trinuclear complexes 1
tripodal ligands 1	TSAR 1	TTF 1
tunnelling 1	Two-photon absorption 1	two-photon spectra 2
two-step spin transition 1	ultrafast processes 1	ultrafast spectroscopy 1
ultraviolet spectra 1	upconversion 1	upper excited states 1
UV excitation 1	UV/Vis spectroscopy 1	V³⁺ electronic structure 1
van der Waals complexes 1	Vanadium trisoxalate 1	variational techniques 1
VECTORS 1	vibrational circular dichroism 1	vibrational relaxation 1
vibrational spectra 1	vibrational spectroscopy 2	vibronic structure 1
vicarious nucleophilic substitution 1	visible light 1	visible radiation 1
water 1	water column 1	water oxidation 1
wave functions 2	weak intermolecular complexes 1	Wulf transition 1
X ray diffraction 1	x-ray crystallography 1	X-ray diffraction 11
X-ray single crystal and powder diffraction 1	XRD 2	Yb3+ 1
ylides 1	zero-field splittings 1	zinc 1

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