| π interactions 1 |
1,1'-binaphthyl-2,2'-dithiol 1 |
1,2-dioleoyl-sn-glycero-3-phosphoethanolamine (DOPE) 1 |
| 11B and 1H NMR chemical shifts 1 |
14N 1 |
16O3 1 |
| 18O3 1 |
1H 1 |
2-Pyrone 1 |
| 2E state 1 |
3,5-Di(trifluoromethyl)acetophenone 1 |
31P 1 |
| 31P hyperfine coupling 1 |
3D oxalate networks 1 |
3D-QSAR 1 |
| 3MLCT 1 |
4 14-Dimethycholestane 1 |
57Fe Mössbauer spectroscopy 1 |
| [1,2]-Stevens rearrangement 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 |
| ab initio structure determination 1 |
absorption 1 |
absorption spectra 1 |
| Acid effect 1 |
Activated ketones 1 |
activation energy 1 |
| Adsorption 1 |
afterglow 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 |
all-solid-state lithium-ion batteries 1 |
| allenes 1 |
AMDIS 1 |
aminoxyls 1 |
| ammonium 1 |
amphiphiles 1 |
amphiphilic brushes 1 |
| anharmonicity 2 |
anils 1 |
anisotropic diffraction peak broadening 1 |
| anisotropic ligand fields 1 |
anisotropy 2 |
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 catalysis 2 |
| Asymmetric heterogeneous catalysis 1 |
Asymmetric hydrogenation 1 |
asymmetric synthesis 2 |
| atom transfer radical polymerization (ATRP) 1 |
atom-molecule reactions 1 |
ATR-FTIR 1 |
| attenuated total reflection 2 |
azepine 1 |
azides 1 |
| azocine 1 |
Ba12F19Cl5 1 |
Ba2In2O5 1 |
| Ba2Mg3F10 1 |
BaFBr 2 |
BaFI 1 |
| BaMgF4:Eu 1 |
band models 1 |
barium 2 |
| Barium fluorides 1 |
barium halides 2 |
barium periodate 1 |
| barium strontium fluorohalides 1 |
Bariumfluorochloride 1 |
basis set 1 |
| basis sets 2 |
binary compounds 1 |
BINDING 1 |
| Binding assays 1 |
biogenic methane 1 |
biomimetic 1 |
| biomimetic membrane 1 |
biosensors 1 |
bis-iminophosphoranes 1 |
| bistability 1 |
block copolymers 1 |
blue phosphor 1 |
| bond theory 1 |
bonding 2 |
boranils 1 |
| boric acid 1 |
borohydrides 6 |
boron 1 |
| boron-hydrogen species 2 |
bridged compounds (heterocyclic compounds) 1 |
BSA adsorption 1 |
| CaF2 1 |
calcium 2 |
calcium borohydride 1 |
| Calciumfluoride: Samarium 1 |
capillary electrophoresis 1 |
carbenes 1 |
| carbenium ions 2 |
CASPT2 1 |
catalyst 2 |
| CaTiO3:Pr 1 |
cation radical 1 |
cationic surfactant 1 |
| cetylpyridinium bromide 1 |
charge exchange 1 |
charge transfer 8 |
| chemical bonds 1 |
Chemical composition 1 |
chemical potential 1 |
| chemical pressure 2 |
chemical reactions 2 |
chemical shift 1 |
| chemical shifts 1 |
chemical stability 1 |
chemisorption 3 |
| chiral anionic surfactant 1 |
chiral mesoporous silica 1 |
Chiral polymers 1 |
| chiral resolution 2 |
chiral surfaces 2 |
chirality 4 |
| chromium 1 |
chromium complexes 1 |
chromium(III)-tris-oxalate 1 |
| Cinchonidine 2 |
Cinchonine 1 |
circular dichroism 5 |
| circularly polarized luminescence 1 |
classical Coulomb energy 1 |
click chemistry 1 |
| closoboranes 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 |
complex hydrides 1 |
computational chemistry 4 |
| computer simulation 1 |
computer simulations 1 |
conceptual DFT 1 |
| condensed matter 1 |
conducting materials 1 |
configuration determination 1 |
| configuration interactions 2 |
configurational coordinate 1 |
configurational stability 1 |
| conformation 2 |
conformers 1 |
continuum models 1 |
| controlled release 1 |
cooperative effects 5 |
cooperativity 1 |
| coordination bond 1 |
coordination chemistry 1 |
coordination modes 1 |
| copper 2 |
copper peroxide 1 |
copper superoxide 1 |
| correlation 1 |
COST 1 |
coupled cluster calculations 1 |
| Cr(III) 1 |
Cr-substitution 1 |
creatine kinase 1 |
| crown ethers 1 |
cryo-electron microscopy 1 |
cryptands 1 |
| crystal and ligand fields 1 |
crystal Field 3 |
crystal fields 1 |
| crystal growth 4 |
crystal growth contest 1 |
crystal structure 16 |
| crystal structures 1 |
crystallinity 1 |
crystallography and society 1 |
| cyanide bridging ligand 1 |
cyclic trimers 1 |
Cyclic voltammetry 3 |
| cyclometallated ligand complexes 1 |
database 1 |
DC(8,9)PC 1 |
| deconvolution 1 |
delays 1 |
delocalization 2 |
| denaturation 1 |
dendrimers 1 |
density functional 1 |
| density functional calculations 15 |
density functional method 1 |
density functional theory 28 |
| DFT 6 |
DFT calculations 4 |
DFT on closoboranes 1 |
| diazo compounds 1 |
dibenzylsquaramide 1 |
dielectric constant 1 |
| dielectric properties 1 |
diffraction 1 |
dinuclear complexes 1 |
| Dioxygen sensors 1 |
dipyrido[3,2-a:2',3'-c]phenazines 1 |
directed self-assembly 1 |
| disorder 1 |
disordered crystals 1 |
disordered solids 1 |
| disordered structure 1 |
dissociation energies 1 |
DNA recognition 1 |
| dodecaborate 1 |
domain effects 1 |
donor-acceptor systems 5 |
| Donoreacceptor systems 1 |
Donor–acceptor compound 1 |
doping 1 |
| DTA 1 |
dust, extinction 1 |
edge channel 1 |
| education 1 |
eigenvalues and eigenfunctions 1 |
elasticity 1 |
| electrical conductivity 1 |
electrically charged ionophore 1 |
electrochemical impedance spectroscopy 1 |
| electrochemistry 3 |
electron correlations 1 |
electron delocalization 1 |
| electron density 2 |
Electron energy loss spectroscopy (EELS) 1 |
electron gas 1 |
| electron localization 1 |
electron localization function 1 |
electron scattering 1 |
| electron spin resonance 1 |
electron transfer 4 |
Electronic spectroscopy 1 |
| electronic states 1 |
electronic structure 2 |
electrostatic potentials 1 |
| elpasolite 1 |
embedding 5 |
embedding potential 2 |
| embedding theory 1 |
enantiodiscrimination 1 |
Enantioselective hydrogenation 2 |
| enantioselectivity 2 |
encapsulation 1 |
energy conversion 1 |
| energy migration 2 |
energy transfer 3 |
entropy 1 |
| 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 energies 2 |
| excitation energy hopping 1 |
excitation energy transfer 1 |
excited states 3 |
| Experimental study 2 |
external pressure 1 |
extrusion 1 |
| f-f transitions 1 |
Fano resonance 1 |
fas-solid interface 1 |
| Fe(II) compunds 1 |
femtochemistry 1 |
femtosecond laser 1 |
| ferroelectric monodomains 1 |
FG method 1 |
fluorescence 5 |
| fluorescence line narrowing 2 |
fluorescence spectroscopy 1 |
fluorescence spetcra 1 |
| fluorescent materials 1 |
fluorescent probes 2 |
fluoride 1 |
| fluorides 5 |
fluorination 1 |
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 |
| frozen-density 1 |
frozen-density embedding theory 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 5 |
gold nanoparticles 2 |
| Grignard reagents 1 |
ground states 1 |
guest host interaction 1 |
| HAMSTER OVARY CELLS 1 |
heat capacity 1 |
heavy fermions 1 |
| helical cation 1 |
helical structures 6 |
helicate 1 |
| helicates 1 |
helicenes 4 |
heme 1 |
| HEPT 1 |
heterobimetallic complexes 1 |
heterocycles 3 |
| heterodinuclear complexes 1 |
heterometallic 1 |
Hexagonal Crystal Structure 1 |
| HF calculations 1 |
hHelicenes 1 |
high energy density material 1 |
| high energy density material (HEDM) 1 |
high pressure 4 |
high pressure lifetime 1 |
| high pressure luminescence 1 |
high pressures 1 |
high spin-low spin relaxation 1 |
| high triplet energy 1 |
high-pressure 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 |
homogeneity 1 |
host-guest systems 2 |
| hybrid quantum mechanical/molecular mechanics (QM/MM) approaches 1 |
hydride 1 |
hydrides 5 |
| hydrogen 1 |
hydrogen absorbing materials 1 |
hydrogen bonding 3 |
| hydrogen bonds 1 |
hydrogen desorption under dynamic vacuum 1 |
hydrogen neutral atoms 1 |
| hydrogen neutral molecules 1 |
Hydrogen storage 9 |
Hydrogen storage material 1 |
| hydrogen storage materials 5 |
hydrogen transfer 2 |
hydrogen-bonded complexes 1 |
| Hydrogenation 2 |
hydrolysis 2 |
hyperconjugation 1 |
| hyperfine structure 2 |
hysteresis 2 |
impedance spectroscopy 1 |
| implant 1 |
impurity absorption spectra 1 |
in situ experiments 1 |
| in situ spectroscopy 3 |
in situ XANES 1 |
incentive science 1 |
| indoline 1 |
Inelastic X-ray scattering 1 |
infrared and Raman spectroscopy 2 |
| injection-molding 1 |
inorganic cluster 1 |
inorganic compounds 5 |
| inorganic hybrid composites 1 |
inorganic synthesis 2 |
insertion 1 |
| instability 1 |
insulators 1 |
integer quantum Hall effect 1 |
| intermetallic 2 |
intermetallic compound 1 |
intermolecular interactions 2 |
| internal rotation 1 |
interrnational year of crystallography 2014 1 |
interstellar hydroxylamine chemistry 1 |
| intersystem crossing 5 |
Intra cavity laser absorption spectroscopy (ICLAS) 1 |
intramolecular charge-transfer 1 |
| Inversion of enantioselectivity 1 |
inverted hexagonal structure 1 |
ion pairs 1 |
| Ion substitution 1 |
ionic liquids 1 |
ionophore-based membranes 1 |
| IR 2 |
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 |
| irreversible phase transition 1 |
ISM: molecules 1 |
isomerization 2 |
| Jahn-Teller distortion 1 |
Jahn-Teller effect 1 |
Jahn-Teller effects 1 |
| Ketopantolactone 1 |
keystone mechanism 1 |
kinetic energy functional 5 |
| kinetic resolution 1 |
kinetic-energy functional 1 |
kinetics 2 |
| KSCED 1 |
L-arginine 1 |
L-Proline 1 |
| lake Lugano methane 1 |
lanthanide 2 |
lanthanides 5 |
| laser 1 |
laser photoexcitation 1 |
laser spectroscopy 1 |
| lattice vibrations 1 |
Le Bail fit 1 |
lead halides 1 |
| lead periodates 1 |
LIESST 4 |
LIESST effect 1 |
| ligand field theory 1 |
ligand-field 1 |
ligand-field states 2 |
| ligand-field theory 1 |
light induced thermal hysteresis 1 |
linear-response 1 |
| lipid bilayer 1 |
lipid nanotube 1 |
lipid nanotubes 2 |
| lipid self-assembly 1 |
liposomes 2 |
liquid crystals 2 |
| liquid-crystals 1 |
lithium sulfides 1 |
Londo-Hückel 1 |
| low efficiency roll-off 1 |
low index single crystal surfaces 1 |
Low Temperature Gel Method 1 |
| luminescence 17 |
luminescence quenching 1 |
Luminescence spectroscopy 1 |
| luminescent materials 1 |
macrocyclic ligands 1 |
magnesium 1 |
| Magnesium fluorides 1 |
magnetic impurities 1 |
magnetic phase transition 1 |
| magnetic properties 4 |
Magnetic property 1 |
magnetism 1 |
| magnetization 1 |
magnetization curves 1 |
main group elements 1 |
| malaria 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 |
| mechanochromic polymer 1 |
mechanochromism 1 |
mechanoelastic model 1 |
| melittin 3 |
membranes 1 |
metal 1 |
| metal carbenes 1 |
metal hydrides 2 |
metal interactions 1 |
| metal-metal interactions 1 |
metallacycles 1 |
metalloenzyme catalyzed reaction 1 |
| metallomesogens 1 |
metastable compounds 1 |
metastable states 1 |
| metathesis 3 |
methods: laboratory 1 |
Mg(BH4)2 1 |
| microfluidic systems 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 5 |
molecular dynamics method 1 |
| molecular electronic states 1 |
molecular magnetism 1 |
molecular mechanics 1 |
| molecular modeling 1 |
molecular upconversion 1 |
Monte Carlo methods 1 |
| Monterey 1 |
multi pixel photon counter (MPPC) 1 |
multi-level 1 |
| multi-level simulations 2 |
multichromophoric systems 1 |
multiconfigurational SCF theory 1 |
| multiplet structure 1 |
Mutagenesis, site-directed 1 |
N ligands 4 |
| N-hydroxyamino 1 |
N8 isomers 1 |
nanoarchitecture 1 |
| nanocrystals 3 |
nanographene 1 |
nanoparticles 7 |
| nanorods 1 |
nanostructures 1 |
nanowires 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 |
| nitrite 1 |
nitrogen clusters 1 |
nitrogen heterocycles 2 |
| NOE 1 |
non-covalent interactions 1 |
nonadiabatic multiphonon relaxation 1 |
| nuclear magnetic resonance 1 |
nuclear spin 1 |
octahydrotriborate 1 |
| one-dimensional polymer structures 1 |
ONIOM 1 |
optical activity 2 |
| optical centre 1 |
optical hole burning 1 |
optical materials 1 |
| optical properties 2 |
Optical property 1 |
optical sensors 1 |
| optical spectrometers 1 |
optical spectroscopy 2 |
optical studies 1 |
| optical waveguide lightmode spectroscopy 1 |
Optically active materials 1 |
orbital-free embedding 5 |
| orbital-free embedding theory 1 |
orbital-free theories 1 |
orbitals 1 |
| organic 1 |
organic compounds 3 |
organic electronics 1 |
| organic fiber 1 |
organocatalysis 1 |
organometallic complexes 1 |
| organometallic compounds 1 |
outreach initiative 1 |
oxalate networks 3 |
| oxetanes 1 |
oxonium ylides 1 |
oxygen vacancies 1 |
| Ozone 1 |
P ligands 3 |
Palladium 1 |
| palladium complexes 1 |
patterning 1 |
PEPTIDES 2 |
| perovskite 1 |
persistent luminescence 2 |
persistent spectral hole burning 1 |
| perturbation theory 3 |
pH sensing 1 |
phase transition 3 |
| phase transitions 1 |
phenol 1 |
PHOLED 1 |
| phonon-assisted energy transfer 1 |
Phonons 1 |
phosphaalkene 2 |
| phosphaallenes 1 |
phosphaallylic radical 1 |
phosphinines 1 |
| phosphorus 2 |
photocatalysis 2 |
photochemistry 6 |
| 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 4 |
photophysics 4 |
photophysics and photochemistry 1 |
| photostability 1 |
Photostimulated luminescence 1 |
photoswitching 1 |
| photosynthesis 1 |
photovoltaics 1 |
phthalocynanines 1 |
| Physical adsorption 1 |
physics computing 1 |
physisorption 2 |
| planar lipid bilayers 1 |
Platinum 2 |
pm-irras 1 |
| point defects 1 |
polarization 1 |
polarized Raman, hyperpolarizability 1 |
| polycyclic aromatic hydrocarbons 1 |
polydiacetylene 1 |
polyelectrolyte 1 |
| polyelectrolyte multilayers 1 |
polyelectrolytes 1 |
polylactic acid 1 |
| polymers 1 |
polymers (inorganic) 1 |
polymorphism 1 |
| polynuclear complexes 2 |
Polypyridyl ligands 1 |
Polysiloxanes 1 |
| pore-forming peptide 1 |
porosity 1 |
porphycenes 2 |
| positive ions 1 |
potassium borohydride 1 |
potassium dihydrogen phosphate 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 |
push-pull chromophores 1 |
Q-switching 1 |
| quadrupolar molecules 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 |
| quasielastic neutron scattering 1 |
radiation chemistry 1 |
radiationless deactivation 1 |
| radical anion 3 |
radicals 4 |
Raman 3 |
| Raman and infrared spectroscopy 1 |
Raman spectroscopy 10 |
rare earth 1 |
| Rare earth compounds 1 |
rare-earth doped materials 1 |
rare-earth elements 2 |
| reaction mechanisms 2 |
reactive ball milling 1 |
rearrangements 1 |
| redox chemistry 5 |
regioselectivity 2 |
relaxation dynamics 1 |
| resonant and phonon-assisted excitation energy migration 1 |
resonant energy transfer 1 |
retention of configuration 1 |
| reverse transcriptase 1 |
ring contraction 2 |
Ring-substituted acetophenones 1 |
| rotating magnetic field 1 |
ruthenium 4 |
ruthenium complexes 2 |
| Ruthenium(II) complex 1 |
Ruthenium(II) complexes 1 |
Ruthenium(II) polypyridyl complexes 1 |
| Rydberg states 1 |
S ligands 1 |
salophen 1 |
| samarium 6 |
sams 1 |
scaffolds 1 |
| scalar field theory 1 |
scaling relations 1 |
SCF calculations 3 |
| school science 1 |
SEAr 1 |
self-assembly 7 |
| self-organization in macromolecules 1 |
Semliki Forest virus system 1 |
sensors 1 |
| Si/SiGe heterostructure 1 |
silica 1 |
silico-aluminate 1 |
| silicon 1 |
silver 1 |
single cell manipulation 1 |
| single channel monitoring 1 |
single exponential decay detector 1 |
single photon time resolution 1 |
| SiPM 1 |
size separation 1 |
Sm2+ 3 |
| SNAr 1 |
sodium compounds 1 |
sodium ortho-periodates 1 |
| solid electrolyte 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 |
solid-state electrolytes 1 |
| solutes 1 |
solution growth 1 |
solvatation 1 |
| solvation 2 |
solvation dynamics 1 |
solvatochromism 2 |
| solvent effects 2 |
solvent-responsive behavior 1 |
solvents 1 |
| somatostatin analogue 1 |
spectral diffusion 2 |
spectral hole burning 1 |
| spectral line breadth 1 |
spectral tuning 1 |
spectroelectrochemistry 1 |
| spectroscopy 3 |
spectrum assignment 1 |
spin crossover 18 |
| spin delocalization 1 |
spin dynamics 1 |
spin glasses 1 |
| spin labeling 1 |
spin relaxation 1 |
spin transition 1 |
| spin-crossover 3 |
spin-transition 1 |
spin-transition solid 1 |
| spiro compounds 1 |
SrAl2O4 1 |
SrF2 1 |
| SrFBr 2 |
stereochemistry 1 |
stereoelectronic 1 |
| stereoelectronic effects 1 |
stereoselectivity 1 |
sterically induced torsion 1 |
| Storage phosphor 1 |
strong vibronic coupling limit 1 |
strontium 1 |
| strontium compounds 1 |
structural changes 1 |
structure elucidation 3 |
| structure refinement 1 |
structure-property relationship 1 |
SUBSTANCE-P 1 |
| subsystem quantum mechanics 1 |
subsystems 1 |
sulfonylation 1 |
| supported lipid bilayer 1 |
supported lipid bilayers (SLBs) 1 |
supramolecular chemistry 1 |
| supramolecular materials 1 |
Surface chemical reaction 1 |
surface-initiated ATRP 1 |
| swimming microrobots 1 |
synchrotron radiation 1 |
synchrotron X-ray diffraction 1 |
| Synthesis 1 |
synthetic methods 1 |
Tachykinin NK1 receptor 1 |
| targeted drug delivery 1 |
tautomerism 2 |
TD-DFT 1 |
| TDDFT 1 |
TDDFT calculations 1 |
temperature lifetime 1 |
| tensors 1 |
ternary metal hydrides 1 |
tetraborate 1 |
| tetrathiafulvalene 4 |
tetrathiafulvalenes 3 |
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 |
thermal oxidation resistance 1 |
thermodynamic control 1 |
| thermodynamic properties 2 |
thermodynamics 2 |
thin films 2 |
| time delay 1 |
time resolution 1 |
time-dependent density functional 1 |
| time-domain analysis 1 |
time-resolved anisotropy 1 |
time-resolved spectroscopy 3 |
| timing jitter 1 |
TiO2 1 |
TiO2, malonic acid 1 |
| TOF-PET 1 |
torsion effusion vapor pressure measurements 1 |
total energy bifunctional 1 |
| transient absorption 2 |
transition metal 1 |
transition metal complexes 2 |
| 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 methods 1 |
ultrafast processes 1 |
ultrafast spectroscopy 3 |
| ultrafast vibrational spectroscopy 1 |
ultraviolet spectra 1 |
ultraviolet spectroscopy 1 |
| upconversion 1 |
upper excited states 1 |
UV excitation 1 |
| UV/Vis spectroscopy 3 |
V3+ electronic structure 1 |
valley splitting 1 |
| van der Waals complexes 1 |
Vanadium trisoxalate 1 |
vaporization thermodynamics 1 |
| variational techniques 1 |
VECTORS 1 |
vibrational circular dichroism 1 |
| vibrational frequencies 2 |
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 attenuation 1 |
wave functions 5 |
weak intermolecular complexes 1 |
| Wulf transition 1 |
X ray diffraction 1 |
x-ray crystallography 1 |
| X-ray diffraction 13 |
X-ray diffraction studies 1 |
X-ray powder diffraction 1 |
| X-ray single crystal and powder diffraction 1 |
XRD 2 |
Yb3+ 1 |
| ylides 2 |
zero-field splittings 1 |
zinc 1 |