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CORC

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Prediction of Ti3C2O2 MXene as an effective capturer of formaldehyde 期刊论文
APPLIED SURFACE SCIENCE, 2019, 卷号: 469, 页码: 770-774
作者:  Zhang, Yujuan[1];  Zhou, Zhangjian[2];  Lan, Jianhui[3];  Zhang, Peihong[4]
收藏  |  浏览/下载：5/0  |  提交时间：2019/04/22
Quasiparticle electronic structure of honeycomb C3N: from monolayer to bulk 期刊论文
2D MATERIALS, 2019, 卷号: 6
作者:  Wu, Yabei[1];  Xia, Weiyi[2];  Gao, Weiwei[3];  Jia, Fanhao[4];  Zhang, Peihong[5]
收藏  |  浏览/下载：11/0  |  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
Fast-forward scaling theory for phase imprinting on a BEC: creation of a wave packet with uniform momentum density and loading to Bloch states without disturbance 期刊论文
NEW JOURNAL OF PHYSICS, 2018, 卷号: 20
作者:  Masuda, Shumpei[1];  Nakamura, Katsuhiro[2];  Nakahara, Mikio[3]
收藏  |  浏览/下载：11/0  |  提交时间：2019/04/24
Rational Density Functional Selection Using Game Theory 期刊论文
JOURNAL OF CHEMICAL INFORMATION AND MODELING, 2018, 卷号: 58, 页码: 61-67
作者:  McAnanama-Brereton, Suzanne[1];  Waller, Mark P.[2]
收藏  |  浏览/下载：3/0  |  提交时间：2019/04/24
Planning chemical syntheses with deep neural networks and symbolic AI 期刊论文
NATURE, 2018, 卷号: 555, 页码: 604-+
作者:  Segler, Marwin H. S.[1];  Preuss, Mike[2];  Waller, Mark P.[3]
收藏  |  浏览/下载：7/0  |  提交时间：2019/04/24
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
Tunable and switchable magnetic dipole patterns in nanostructured superconductors 期刊论文
NATURE COMMUNICATIONS, 2018, 卷号: 9, 页码: 2576
作者:  Ge, Jun-Yi[1];  Gladilin, Vladimir N.[2];  Tempere, Jacques[3];  Devreese, Jozef T.[4];  Moshchalkov, Victor V.[5]
收藏  |  浏览/下载：2/0  |  提交时间：2019/04/22
A Probabilistic Framework for Constructing Temporal Relations in Replica Exchange Molecular Trajectories 期刊论文
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2018, 卷号: 14, 页码: 3365-3380
作者:  Chattopadhyay, Aditya[1];  Zheng, Min[2];  Waller, Mark P.[3];  Priyakumar, U. Deva[4]
收藏  |  浏览/下载：4/0  |  提交时间：2019/04/22
Intrinsic and anisotropic Rashba spin splitting in Janus transition-metal dichalcogenide monolayers 期刊论文
PHYSICAL REVIEW B, 2018, 卷号: 97, 页码: 235404
作者:  Hu, Tao[1];  Jia, Fanhao[2];  Zhao, Guodong[3];  Wu, Jiongyao[4];  Stroppa, Alessandro[5]
收藏  |  浏览/下载：10/0  |  提交时间：2019/04/22

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