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Bioferroelectric Properties of Glycine Crystals 期刊论文
The journal of physical chemistry letters, 2019, 卷号: 10, 页码: 1319-1324
作者:  Hu Pengfei[1];  Hu Shunbo[2];  Huang Yundi[3];  Reimers Jeffrey R[4];  Rappe Andrew M[5]
收藏  |  浏览/下载:13/0  |  提交时间:2019/04/22
Understanding and Calibrating Density-Functional-Theory Calculations Describing the Energy and Spectroscopy of Defect Sites in Hexagonal Boron Nitride 期刊论文
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2018, 卷号: 14, 页码: 1602-1613
作者:  Reimers, Jeffrey R.[1];  Sajid, A.[2];  Kobayashi, Rika[3];  Ford, Michael J.[4]
收藏  |  浏览/下载:16/0  |  提交时间:2019/04/24
Faraday cage screening reveals intrinsic aspects of the van der Waals attraction 期刊论文
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA, 2018, 卷号: 115, 页码: E10295-E10302
作者:  Li, Musen[1];  Reimers, Jeffrey R.[2];  Dobson, John F.[3];  Gould, Tim[4]
收藏  |  浏览/下载:2/0  |  提交时间:2019/04/22
Energy flow in the Photosystem I supercomplex: Comparison of approximative theories with DM-HEOM 期刊论文
CHEMICAL PHYSICS, 2018, 卷号: 515, 页码: 262-271
作者:  Kramer, Tobias[1];  Noack, Matthias[2];  Reimers, Jeffrey R.[3];  Reinefeld, Alexander[4];  Rodriguez, Mirta[5]
收藏  |  浏览/下载:6/0  |  提交时间:2019/04/22
Cyanine platelet single crystals: growth, crystal structure and optical spectra 期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2018, 卷号: 20, 页码: 29166-29173
作者:  Leclaire, Nicolas A.[1];  Li, Musen[2];  Veron, Anna C.[3];  Neels, Antonia[4];  Heier, Jakob[5]
收藏  |  浏览/下载:13/0  |  提交时间:2019/04/22
Polarization effect within a protein crystal: A molecular dynamics simulation study 期刊论文
CHEMICAL PHYSICS LETTERS, 2018, 卷号: 706, 页码: 303-307
作者:  Zhu, Tingting[1];  Wu, Chao[2];  Song, Jianing[3];  Reimers, Jeffrey R.[4];  Li, Yongle[5]
收藏  |  浏览/下载:8/0  |  提交时间:2019/04/22
van der Waals Forces Control the Internal Chemical Structure of Monolayers within the Lamellar Materials CuInP2S6 and CuBiP2Se6 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY C, 2018, 卷号: 122, 页码: 22675-22687
作者:  Tawfik, Sherif Abdulkader[1];  Reimers, Jeffrey R.[2];  Stampfl, Catherine[3];  Ford, Michael J.[4]
收藏  |  浏览/下载:5/0  |  提交时间:2019/04/22
A new fundamental type of conformational isomerism 期刊论文
NATURE CHEMISTRY, 2018, 卷号: 10, 页码: 615-624
作者:  Canfield, Peter J.[1];  Blake, Iain M.[2];  Cai, Zheng-Li[3];  Luck, Ian J.[4];  Krausz, Elmars[5]
收藏  |  浏览/下载:11/0  |  提交时间:2019/04/22
Sulfur ligand mediated electrochemistry of gold surfaces and nanoparticles: What, how, and why 期刊论文
CURRENT OPINION IN ELECTROCHEMISTRY, 2017, 卷号: 1, 页码: 7-15
作者:  Chi, Qijin[1];  Ford, Michael J.[2];  Halder, Arnab[3];  Hush, Noel S.[4];  Reimers, Jeffrey R.[5]
收藏  |  浏览/下载:3/0  |  提交时间:2019/04/24
Solving the scalability issue in quantum-based refinement: Q|R#1 期刊论文
ACTA CRYSTALLOGRAPHICA SECTION D-STRUCTURAL BIOLOGY, 2017, 卷号: 73, 页码: 1020-1028
作者:  Zheng, Min[1];  Moriarty, Nigel W.[2];  Xu, Yanting[3];  Reimers, Jeffrey R.[4];  Afonine, Pavel V.[5]
收藏  |  浏览/下载:4/0  |  提交时间:2019/04/24


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