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 5	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 4	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 2
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 line narrowing 2
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 13
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 3	photodegradation 1	Photodynamic therapy 1
photography 1	photoinduced electron transfer 2	photoluminescence 1
photomagnetism 1	photophysical effects 1	photophysical properties 3
photophysics 1	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 1
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 elements 1	reaction mechanisms 1	reactive ball milling 1
rearrangements 1	redox chemistry 2	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 1
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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