Year |
Citation |
Score |
2023 |
Li W, Wang Y, Ni Z, Li S. Cluster-in-Molecule Local Correlation Method for Dispersion Interactions in Large Systems and Periodic Systems. Accounts of Chemical Research. PMID 37991873 DOI: 10.1021/acs.accounts.3c00538 |
0.591 |
|
2022 |
Xiong Y, Li B, Gu Y, Yan T, Ni Z, Li S, Zuo JL, Ma J, Jin Z. Photocatalytic nitrogen fixation under an ambient atmosphere using a porous coordination polymer with bridging dinitrogen anions. Nature Chemistry. PMID 36522581 DOI: 10.1038/s41557-022-01088-8 |
0.396 |
|
2022 |
Wang Y, Ni Z, Neese F, Li W, Guo Y, Li S. Cluster-in-Molecule Method Combined with the Domain-Based Local Pair Natural Orbital Approach for Electron Correlation Calculations of Periodic Systems. Journal of Chemical Theory and Computation. PMID 36240189 DOI: 10.1021/acs.jctc.2c00412 |
0.624 |
|
2021 |
Chen H, Yang M, Wang G, Gao L, Ni Z, Zou J, Li S. B(CF)-Catalyzed Sequential Additions of Terminal Alkynes to -Substituted Phenols: Selective Construction of Congested Phenol-Substituted Quaternary Carbons. Organic Letters. PMID 34232044 DOI: 10.1021/acs.orglett.1c01863 |
0.536 |
|
2021 |
Ni Z, Guo Y, Neese F, Li W, Li S. Cluster-in-Molecule Local Correlation Method with an Accurate Distant Pair Correction for Large Systems. Journal of Chemical Theory and Computation. PMID 33410327 DOI: 10.1021/acs.jctc.0c00831 |
0.625 |
|
2019 |
Ni Z, Wang Y, Li W, Pulay P, Li S. Analytical Energy Gradients for the Cluster-in-Molecule MP2 Method and its Application to Geometry Optimizations of Large Systems. Journal of Chemical Theory and Computation. PMID 31091102 DOI: 10.1021/Acs.Jctc.9B00259 |
0.638 |
|
2019 |
Wang Y, Ni Z, Li W, Li S. Cluster-in-Molecule Local Correlation Approach for Periodic Systems. Journal of Chemical Theory and Computation. PMID 30920828 DOI: 10.1021/acs.jctc.8b01200 |
0.575 |
|
2019 |
Li W, Duan M, Liao K, Hong B, Ni Z, Ma J, Li S. Improved generalized energy-based fragmentation approach and its applications to the binding energies of supramolecular complexes Electronic Structure. 1: 044003. DOI: 10.1088/2516-1075/ab5049 |
0.417 |
|
2018 |
Ni Z, Li W, Li S. Fully optimized implementation of the cluster-in-molecule local correlation approach for electron correlation calculations of large systems. Journal of Computational Chemistry. PMID 30362560 DOI: 10.1002/jcc.25730 |
0.592 |
|
2017 |
Yuan D, Li Y, Ni Z, Pulay P, Li W, Li S. Benchmark relative energies for large water clusters with the generalized energy-based fragmentation method. Journal of Chemical Theory and Computation. PMID 28478670 DOI: 10.1021/Acs.Jctc.7B00284 |
0.626 |
|
2016 |
Ni Z, Wolinski K, Pulay P. Approximate Force Constants from Uncoupled Self-Consistent Field Perturbation Theory Using Nonhybrid Density Functional Theory. The Journal of Physical Chemistry. A. PMID 27997190 DOI: 10.1021/Acs.Jpca.6B10959 |
0.502 |
|
2016 |
Li W, Ni Z, Li S. Cluster-in-molecule local correlation method for post-Hartree–Fock calculations of large systems Molecular Physics. 1-14. DOI: 10.1080/00268976.2016.1139755 |
0.54 |
|
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