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Computational and Theoretical Chemistry 2017.
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Peter Reinhardt, A possible valence-bond approach to symmetry-adapted perturbation theory.
Computational and Theoretical Chemistry 2017.
174-183.
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Computational and Theoretical Chemistry 2017.
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Emmanuel Giner; Celestino Angeli; Anthony Scemama; Jean‐Paul Malrieu, Orthogonal Valence Bond Hamiltonians incorporating dynamical correlation effects.
Computational and Theoretical Chemistry 2017.
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Chemistry - A European Journal 2016,
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Hailiang Zhao; Shanshan Tang; Siyang Li; Lei Ding; Lin Du, Theoretical investigation of the hydrogen bond interactions of methanol and dimethylamine with hydrazone and its derivatives.
Structural Chemistry 2016,
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International Journal of Molecular Sciences 2016,
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Piyush Mishra; Kanupriya Verma; Deependra Bawari; K. S. Viswanathan, Does borazine–water behave like benzene-water? A matrix isolation infrared and ab initio study.
The Journal of Chemical Physics 2016,
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Zhi Xiang Wong; Matthias Lein, Guest–Host Interaction of Coinage Metals in π-Rich Cavities.
Australian Journal of Chemistry 2016,
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Rahul Shukla; Deepak Chopra, “Pnicogen bonds” or “chalcogen bonds”: exploiting the effect of substitution on the formation of P⋯Se noncovalent bonds.
Physical Chemistry Chemical Physics 2016,
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Peifeng Su; Hongjiang Chen; Wei Wu, An energy decomposition analysis for intramolecular non-covalent interaction in solvated environment.
Science China Chemistry 2016,
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Sara Fakhraee; Maryam Souri, Double hydrogen bond interaction in 7-azaindole complexes with protic solvents.
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Paul R. Horn; Martin Head‐Gordon, Alternative definitions of the frozen energy in energy decomposition analysis of density functional theory calculations.
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Alberto Baggioli; Carlo Cavallotti; Antonino Famulari, Exploring short intramolecular interactions in alkylaromatic substrates.
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Zhenzhen Chen; Wenyong Wang; Changli Zhu; Li Wang; Xin‐Yan Fang; Yong‐Qing Qiu, Probing chemical bonding and optoelectronic properties of Square-Planar Aluminum, Gallium, and Nickel complexes.
Computational and Theoretical Chemistry 2016.
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