Papers citing XMVB
381. Mingxing Ren; Xin Liu; Lina Zhang; Xuhui Lin; Wei Wu; Zhenhua Chen, Compact and accurate ab initio valence bond wave functions for electron transfer: The classic but challenging covalent-ionic interaction in LiF. The Journal of Chemical Physics 2022, 157(8).
382. Sason Shaik*; David Danovich; Philippe C. Hiberty*, On the nature of the chemical bond in valence bond theory. The Journal of Chemical Physics 2022, 157(9).
383. Barbaro Zulueta; Sonia Tulyani; Phillip R. Westmoreland; Michael J. Frisch; E. James Petersson; George A. Petersson; John A. Keith*, A Bond-Energy/Bond-Order and Populations Relationship. Journal of Chemical Theory and Computation 2022, 18(8), 4774-4794.
384. Xuhui Lin*; Yirong Mo*, On the Bonding Nature in the Crystalline Tri‐Thorium Cluster: Core‐Shell Syngenetic σ‐Aromaticity. Angewandte Chemie 2022, 134(37).
385. Xuhui Lin*; Yirong Mo*, On the Bonding Nature in the Crystalline Tri‐Thorium Cluster: Core‐Shell Syngenetic σ‐Aromaticity. Angewandte Chemie International Edition 2022, 61(37).
386. Qing‐Qing Yang; Qiaozhuo Wu; Xiaolong Zhang; Xin Yang; Qingzhong Li*, Hydrogen and halogen bonds formed by MCO3(M = Zn, Cd) and their enhancement by a spodium bond. Molecular Physics 2022, 120(14).
387. Bowei Yuan; Zizhuang Liu; Xiao‐Nan Wu; Shaodong Zhou, On the distinct reactivity of two isomers of [IrC4H2]+ toward methane and water. Science China Chemistry 2022, 65(9), 1720-1724.
388. Yuan Xu; Shu Zhang; Erik Lindahl; Ran Friedman*; Wei Wu; Peifeng Su*, A general tight-binding based energy decomposition analysis scheme for intermolecular interactions in large molecules. The Journal of Chemical Physics 2022, 157(3).
389. Letícia Maia Prates; José Walkimar de M. Carneiro; Maurício Tavares de Macedo Cruz, Influence of the Metal−Support and Metal−Metal Interactions on Pd nucleation and NO adsorption in a Pd4/γ-Al2O3 (110D) model. Research Square (Research Square) 2022.
390. Mustafa M. Kadhim*; Fadhil Faez Sead; Abduladheem Turki Jalil; Taleeb Zedan Taban; Ahmed Mahdi Rheima; Haider Abdulkareem Almashhadani; Mohanad Hatem Shadhar; Sama Hamel*, Al-, Ga-, and In-decorated BP nanotubes as chemical sensors for 2-chloroethanol. Monatshefte für Chemie - Chemical Monthly 2022, 153(7-8), 589-596.
391. Lili Zhao; Sudip Pan; Gernot Frenking, Energy Decomposition Analysis of the Chemical Bond: Scope and Limitation. Elsevier eBooks 2022. 322-361.
392. Forough Rezaie; Siamak Noorizadeh*, Strong Be–Be bonds in double-aromatic bridged Be2(μ-SO) molecules. Dalton Transactions 2022, 51(33), 12596-12603.
393. Jiani Liu; Jiarui Zeng; Duokai Zhao; Yao Yao*; Dehua Hu; Yuguang Ma, Comprehending radicals, diradicals and their bondings in aggregates of imide-fused polycyclic aromatic hydrocarbons. Chemical Science 2022, 13(34), 9985-9992.
394. Lili Zhang; Yanli Zeng; Xiaoyan Li; Xueying Zhang, Noncovalent interactions between benzochalcogenadiazoles and nitrogen bases. Journal of Molecular Modeling 2022, 28(9).
395. Francesco Sessa; Martin Rahm*, Electronegativity Equilibration. The Journal of Physical Chemistry A 2022, 126(32), 5472-5482.
396. Sean A. C. McDowell*; Na Liu; Qingzhong Li*, Noncovalent interactions in model molecular clusters containing the tetrel atoms Si and Ge. Molecular Physics 2022, 120(17).
397. Binod Kumar Oram; Saptarshi Sarkar; Monu Monu; Biman Bandyopadhyay*, A comparative study of the potential energy surfaces of (CO)2, CO-CS and (CS)2. Computational and Theoretical Chemistry 2022. 113849-113849.
398. Y. Bhargav Kumar; Anwesh Pandey; Nandan Kumar; G. Narahari Sastry, Binding propensity and selectivity of cationic, anionic, and neutral guests with model hydrophobic hosts: A first principles study. Journal of Computational Chemistry 2022, 44(3), 432-441.
399. Tore Brinck; André Nyberg Borrfors, The Importance of Electrostatics and Polarization for Noncovalent Interactions: Ionic Hydrogen Bonds vs Ionic Halogen Bonds. Journal of Molecular Modeling 2022, 28(9).
400. Yirong Mo*; David Danovich; Sason Shaik, The roles of charge transfer and polarization in non-covalent interactions: a perspective from ab initio valence bond methods. Journal of Molecular Modeling 2022, 28(9).