1241. Padeleimon Karafiloglou; Katerina Kyriakidou, Unpaired electrons, spin polarization, and bond orders in radicals from the 2‐RDM in orbital spaces: Basic notions and testing calculations. International Journal of Quantum Chemistry 2014, 114(11), 696-707.

1242. Zhenhua Chen; Xun Chen; Fuming Ying; Junjing Gu; Huaiyu Zhang; Wei Wu, Nonorthogonal orbital based n-body reduced density matrices and their applications to valence bond theory. III. Second-order perturbation theory using valence bond self-consistent field function as reference. The Journal of Chemical Physics 2014, 141(13).

1243. Liangyu Guan; Yirong Mo, Electron Transfer in Pnicogen Bonds. The Journal of Physical Chemistry A 2014, 118(39), 8911-8921.

1244. Mohammad Solimannejad; Elham Bayati; Mehdi D. Esrafili, Enhancement effect of lithium bonding on the strength of pnicogen bonds: XH2P···NCLi···NCY as a working model (X = F, Cl; Y = H, F, Cl, CN). Molecular Physics 2014, 112(15), 2058-2062.

1245. Mehdi D. Esrafili; Fariba Mohammadian‐Sabet, Ab initio calculations of cooperativity effects on chalcogen bonding: linear clusters of (OCS)2–8 and (OCSe)2–8. Structural Chemistry 2014, 26(1), 199-206.

1246. Mehdi D. Esrafili; Mahshad Vakili; Mohammad Solimannejad, Cooperative interaction between π-hole and single-electronσ-hole interactions in O2S···NCX···CH3and O2Se···NCX···CH3complexes (X = F, Cl, Br and I). Molecular Physics 2014, 112(16), 2078-2084.

1247. Peter D. Jarowski; Yirong Mo, Two States Are Not Enough: Quantitative Evaluation of the Valence‐Bond Intramolecular Charge‐Transfer Model and Its Use in Predicting Bond Length Alternation Effects. Chemistry - A European Journal 2014, 20(51), 17214-17221.

1248. David Danovich; Philippe C. Hiberty*; Wei Wu; Henry S. Rzepa; Sason Shaik*, The Nature of the Fourth Bond in the Ground State of C2: The Quadruple Bond Conundrum. Chemistry - A European Journal 2014, 20(21), 6220-6232.

1249. Dandamudi Usharani; Wenzhen Lai; Chunsen Li; Hui Chen; David Danovich; Sason Shaik, A tutorial for understanding chemical reactivity through the valence bond approach. Chemical Society Reviews 2014, 43(14), 4968-4988.

1250. Nandun M. Thellamurege; Dejun Si; Fengchao Cui; Hui Li, Quantum mechanical/molecular mechanical/continuum style solvation model: Second order Møller-Plesset perturbation theory. The Journal of Chemical Physics 2014, 140(17).

1251. Kevin Lynch; Adam Maloney; Austin Sowell; Changwei Wang; Yirong Mo; Joel M. Karty, Why is sulfuric acid a much stronger acid than ethanol? Determination of the contributions by inductive/field effects and electron-delocalization effects. Physical Chemistry Chemical Physics 2014, 17(1), 138-144.

1252. Yirong Mo; Changwei Wang; Liangyu Guan; Benoı̂t Braı̈da; Philippe C. Hiberty; Wei Wu, On the Nature of Blueshifting Hydrogen Bonds. Chemistry - A European Journal 2014, 20(27), 8444-8452.

1253. Georgios Leonis; Aggelos Avramopoulos; Ramin Ekhteiari Salmas; Serdar Durdağı; Mine Yurtsever; Μάνθος Γ. Παπαδόπουλος, Elucidation of Conformational States, Dynamics, and Mechanism of Binding in Human κ-Opioid Receptor Complexes. Journal of Chemical Information and Modeling 2014, 54(8), 2294-2308.

1254. Zhifeng Li; Huixue Li; Xiaoping Yang, The mutual interactions based on amphipathic tetraoxacalix[2]arene[2]triazine: recognition cases of anion and cation investigated by a computational study. Physical Chemistry Chemical Physics 2014, 16(47), 25876-25882.

1255. Sudip Pan; Diego Moreno; Gabriel Merino*; Pratim Kumar Chattaraj*, Stability of Noble‐Gas‐Bound SiH3+ Clusters. ChemPhysChem 2014, 15(16), 3554-3564.

1256. David Danovich; Sason Shaik, Bound Triplet Pairs in the Highest Spin States of Monovalent Metal Clusters. 2014. 149-174.

1257. Avital Shurki; Étienne Derat; Alexandre Barrozo; Shina Caroline Lynn Kamerlin, How valence bond theory can help you understand your (bio)chemical reaction. Chemical Society Reviews 2014, 44(5), 1037-1052.

1258. Mehdi D. Esrafili; Mahshad Vakili; Mohammad Solimannejad, Theoretical study of the complementarity in halogen–bonded complexes involving nitrogen and halogen as negative sites. Journal of Molecular Modeling 2014, 20(2).

1259. Maitreyi Robledo; Néstor F. Aguirre; Sergio Díaz‐Tendero*; Fernando Martı́n; Manuel Alcamı́, Bonding in exohedral metal–fullerene cationic complexes. RSC Advances 2014, 4(95), 53010-53020.

1260. Xin Guo; Lishui Cao; Qingzhong Li; Wenzuo Li; Jianbo Cheng, Competition between π-hole interaction and hydrogen bond in the complexes of F2XO (X = C and Si) and HCN. Journal of Molecular Modeling 2014, 20(11).