Chemistry
Electronic State
100%
Ground State
43%
Chemical Bond
21%
Isomerization
20%
Locked Nucleic Acid
20%
Dissociation Energy
19%
Excited State
19%
Pi Bond
16%
Multireference Configuration Interaction
16%
CASSCF Calculation
16%
Møller-Plesset Perturbation Theory
15%
Molecular Orbital
15%
Configuration Interaction
13%
Ab Initio Calculation
13%
Raman Spectrum
11%
Enthalpy of Formation
11%
Antisense Oligonucleotide
10%
Electrostatic Potential
10%
Excitatory Amino Acid
10%
Sodium
10%
Strontium
10%
Dimerization
10%
Raman Optical Activity
10%
Vibrational Circular Dichroism Spectroscopy
10%
4H-Chromene
10%
Thiocarbonyl Compound
10%
Powder Diffraction
10%
Phosphorus Atom
10%
Phosphorothioate Oligonucleotide
10%
Oligomer
10%
Spectroscopy
10%
Nitrogen Atom
10%
Nitrogen Dioxide
10%
Nitrite
10%
Oligonucleotide
10%
Voltammetry
10%
Metalloprotein
10%
Cytochrome
10%
Multi-Configuration Self-Consistent Field Calculation
8%
Sigma Bond
8%
IC50
8%
Trimerization
7%
Gaussian Distribution
6%
Physical Chemistry
6%
Triple Bond
6%
Vibrational Frequency
6%
Chirality
5%
Spin-Orbit Coupling
5%
Germanium Ion
5%
Transition State
5%
Keyphrases
All-electron
30%
Ab Initio Investigations
20%
Low-lying Electronic States
18%
Complete Active Space Self-consistent Field (CASSCF)
15%
Relativistic Corrections
15%
Multireference Configuration Interaction
15%
Configuration Interaction Calculations
15%
Angstrom
15%
Field Mass
10%
NiGe
10%
Electronic Nature
10%
Equilibrium Experiments
10%
Decomposition Products
10%
Isomerization Reaction
10%
Thiocarbonyl Compounds
10%
Cyclic Oligomers
10%
Thioaldehydes
10%
Spectrometric Measurements
10%
Knudsen Effusion
10%
Low-lying Excited States
10%
π-bonding
10%
Low-lying States
10%
Spectroscopic Constants
10%
Electronic States
10%
Quantum Mechanical Study
10%
Multi-configuration
10%
Configurational Assignment
10%
Chromene-3-carbonitrile
10%
4H-chromene
10%
2-amino-4
10%
Excitatory Amino Acid Transporter
10%
UCPH-101
10%
Self-consistent Field
10%
Quantum Chemical Model Calculations
10%
Phosphorothioate Oligonucleotides
10%
Copper Nitrite Reductase
10%
Two-center
10%
Cytochrome
10%
Voltammetry
10%
Electrocatalytic
10%
Single-molecule Conductance
10%
Redox Metalloproteins
10%
Antisense Oligonucleotide Drug
10%
Trimerization
7%
Orbital Images
5%
Back-donation
5%
Divalent
5%
Second-order Perturbation
5%
Ab Initio Hartree-Fock
5%
Perturbation Calculation
5%
