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Hydrogen bond  4 times
Halogen  3 times
Chemical bond  3 times
Carbon  3 times
Proton  2 times
Properties of water  2 times
Nitrogen  2 times
Ligand  2 times
Ionization  2 times
Ion  2 times
Gibbs free energy  2 times
Enthalpy  2 times
Collision-induced dissociation  2 times
Carbonyl group  2 times
Benzene  2 times
Wave function  1 time
Transition metal  1 time
Topological data analysis  1 time
Thiourea  1 time
Spectroscopy  1 time
Solvation  1 time
Pyridine  1 time
Pitting corrosion  1 time
Photon  1 time
Phenylalanine  1 time
Northeast China  1 time
Nitrate  1 time
Nickel  1 time
Morpholine  1 time
Monsoon  1 time
Molecular dynamics  1 time
Microscope  1 time
Medical ultrasound  1 time
Mathematical optimization  1 time
Mass spectrometry  1 time
Lead  1 time
Kinetic energy  1 time
Isotope  1 time
Intermolecular force  1 time
Infrared spectroscopy  1 time
Hydrogen  1 time
Germanium  1 time
Gastrointestinal stromal tumor  1 time
Fullerene  1 time
Frequency analysis  1 time
Fossil fuel  1 time
Formaldehyde  1 time
Fingerprint  1 time
Electrospray ionization  1 time
Dipeptide  1 time
Density functional theory  1 time
Covalent bond  1 time
Correlation and dependence  1 time
Conformational isomerism  1 time
Chloride  1 time
China  1 time
Calorimetry  1 time
Boron  1 time
Bond-dissociation energy  1 time
Biomass  1 time
Binding energy  1 time
Austenite  1 time
Angular momentum coupling  1 time
Aldehyde  1 time
Adsorption  1 time
Acid  1 time
Acetaldehyde  1 time

Publications tagged with this subject: 21

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1. Historical pyrogenic sources of black carbon during the last 150 years in the Great Hinggan Mountains, Northeast China

2. Performance of the RI and RIJCOSX approximations in the topological analysis of the electron density

3. Corrosion resistance of high-strength austenitic chromium–nickel–manganese steel containing nitrogen

4. Borylene as an electron-pair donor for P…B pnicogen bonds

5. Ab initio prediction of plausible conformers of a flexible N-(3-chloro-4-fluorophenyl)thiourea (CFT) molecule: A validation study

6. Energetic effects of alkyl groups (methyl and ethyl) on the nitrogen of the morpholine structure

7. Stabilisation of the [6]-prismane structure by silicon substitution

8. The structure and vibrational spectral parameters of a complex of HF with the planar (H2CO)2 dimer

9. How Hot are Your Ions Really? A Threshold Collision-Induced Dissociation Study of Substituted Benzylpyridinium “Thermometer” Ions

10. Hyperechoic demarcation line between a tumor and the muscularis propria layer as a marker for deciding the endoscopic treatment of gastric submucosal tumor

11. Density functional theory insight into Eu(III) and Am(III) complexes with two 2,6-dicarboxypyridine diamide-type ligands

12. Pnicogen bond interaction between PF2Y (Y = –C☰N, –N☰C) with NH3, CH3OH, H2O, and HF molecules

13. Triel bonds-complexes of boron and aluminum trihalides and trihydrides with benzene

14. Molecular engineering of the electronic, structural, and electrochemical properties of nanostructured 1-methyl-4-phenyl 1,2,4 triazolium-based [PhMTZ][X1–10] ionic liquids through anionic changing

15. Comparison of hydrogen- and halogen-bonding interactions in the complexes of the substituted carbonyl compounds with hypohalous acids and monohaloamines

16. Formation and structure specifics of the SnCl4 complex with pyridine-3-carboxylic acid chloride by ab initio calculations

17. A theoretical study of the H n F4−n Si:N-base (n = 1–4) tetrel-bonded complexes

18. Thermodynamic study of nanoclusters of lead (Pb n , n = 1–6): adsorption of small molecules on the Pb n clusters

19. Investigation of the encapsulation of metal cations (Cu2+, Zn2+, Ca2+ and Ba2+) by the dipeptide Phe–Phe using natural bond orbital theory and molecular dynamics simulation

20. Theoretical study of noncovalent interactions in XCN···YO2H (X = F, Cl, Br, I; Y = P, As, Sb) complexes

21. Influence of Transition Metal Cationization versus Sodium Cationization and Protonation on the Gas-Phase Tautomeric Conformations and Stability of Uracil: Application to [Ura+Cu]+ and [Ura+Ag]+


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