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 5	aromatics 1
artemisinin 1	astrochemistry 1	Asymmetric 1
Asymmetric heterogeneous catalysis 1	Asymmetric hydrogenation 1	asymmetric synthesis 2
atom transfer radical polymerization (ATRP) 1	atom-molecule reactions 1	attenuated total reflection 2
azides 1	Ba12F19Cl5 1	Ba2Mg3F10 1
BaFBr 2	BaFI 1	BaMgF4:Eu 1
barium 2	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 2	borohydrides 5	boron 1
BSA adsorption 1	CaF2 1	calcium 2
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	chemical stability 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	click chemistry 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	conceptual DFT 1
condensed matter 1	conducting materials 1	configuration interactions 2
configurational coordinate 1	conformation 2	conformers 1
cooperative effects 4	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	crystallinity 1
cyanide bridging ligand 1	cyclic trimers 1	Cyclic voltammetry 3
cyclometallated ligand complexes 1	deconvolution 1	delays 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 4
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 2	Electron energy loss spectroscopy (EELS) 1
electron localization 1	electron localization function 1	electron spin resonance 1
electron transfer 4	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	femtosecond laser 1
ferroelectric monodomains 1	FG method 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 lifetime 1
high pressure luminescence 1	high pressures 1	high spin-low spin relaxation 1
high-resolution spectroscopy 1	high-speed optical techniques 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 6
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 4
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	measurement by laser beam 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 pixel photon counter (MPPC) 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 5
nanorods 1	nanostructures 1	Naphthopyranone 1
near infrared luminescence 1	Near-IR luminescence 1	neodymium 1
neural network 1	neutron diffraction 2	nickel 2
NINO 1	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 sensors 1
optical spectrometers 1	optical spectroscopy 2	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	photochromism 1	photodegradation 1
photodetectors 1	Photodynamic therapy 1	photoexcitation 1
photography 1	photoinduced bistability 1	photoinduced electron transfer 2
photoluminescence 1	photolysis 1	photomagnetism 1
photophysical effects 1	photophysical properties 3	photophysics 2
photostability 1	Photostimulated luminescence 1	photoswitching 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	probes 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
Q-switching 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 9	Rare earth compounds 1	rare-earth doped materials 1
rare-earth elements 1	reaction mechanisms 1	reactive ball milling 1
rearrangements 1	redox chemistry 4	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	single photon time resolution 1
SiPM 1	site-directed 1	size separation 1
Sm2+ 2	sodium compounds 1	sodium ortho-periodates 1
solid lasers 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 14	spin delocalization 1
spin dynamics 1	spin labeling 1	spin relaxation 1
spin transition 1	spin-crossover 3	spin-transition 1
spin-transition solid 1	spiro compounds 1	SrF2 1
SrFBr 2	stereoelectronic 1	stereoelectronic effects 1
stereoselectivity 1	Storage phosphor 1	strong vibronic coupling limit 1
strontium 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
temperature lifetime 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-domain analysis 1	time-resolved anisotropy 1	time-resolved spectroscopy 2
timing jitter 1	TiO2 2	TOF-PET 1
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
ultraviolet spectroscopy 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 2	vibrational spectroscopy 2	vibronic structure 1
vicarious nucleophilic substitution 1	visible light 1	visible radiation 1
visible spectroscopy 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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