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北京大学 [32]

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期刊论文 [32]

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限定条件	内容类型：期刊论文专题：北京大学第一署名单位第一作者单位通讯作者单位

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	Performance of TD-DFT for Excited States of Open-Shell Transition Metal Compounds 期刊论文 JOURNAL OF PHYSICAL CHEMISTRY A, 2017 Suo, Bingbing; Shen, Kaiyuan; Li, Zhendong; Liu, Wenjian 收藏 \| 浏览/下载：7/0 \| 提交时间：2017/12/03 DENSITY-FUNCTIONAL THEORY MULTIREFERENCE PERTURBATION-THEORY GAUSSIAN-BASIS SETS GENERALIZED-GRADIENT-APPROXIMATION CORRELATED MOLECULAR CALCULATIONS CONFIGURATION-INTERACTION METHOD POTENTIAL-ENERGY SURFACES MODEL-SPACE COEFFICIENTS COUPLED-CLUSTER METHOD ANO BASIS-SETS
	Atomically Dispersed Fe/N-Doped Hierarchical Carbon Architectures Derived from a Metal-Organic Framework Composite for Extremely Efficient Electrocatalysis 期刊论文 ACS ENERGY LETTERS, 2017 Zhu, Qi-Long; Xia, Wei; Zheng, Li-Rong; Zou, Ruqiang; Liu, Zheng; Xu, Qiang 收藏 \| 浏览/下载：3/0 \| 提交时间：2017/12/03 OXYGEN REDUCTION REACTION POROUS CARBON IN-SITU FUEL-CELLS NONPRECIOUS ELECTROCATALYSTS COORDINATION POLYMER NANOPOROUS CARBONS PROTON CONDUCTION ION BATTERIES IRON CARBIDE
	DUGKS simulations of three-dimensional Taylor-Green vortex flow and turbulent channel flow 期刊论文 12th International Conferences on Mesoscopic Methods in Engineering and Science (ICMMES), 2017 Bo, Yuntian; Wang, Peng; Guo, Zhaoli; Wang, Lian-Ping 收藏 \| 浏览/下载：6/0 \| 提交时间：2017/12/03 Discrete unified gas kinetic scheme Lattice Boltzmann equation Pseudo-spectral methods 3D Taylor-Green vortex flow Turbulent channel flow GAS-KINETIC SCHEME LATTICE BOLTZMANN METHOD DIRECT NUMERICAL-SIMULATION RELAXATION-TIME EQUATION PARTICLES CONTINUUM MODEL
	煤基碳泡沫/聚氨酯相变复合材料的制备及储热性能期刊论文物理化学学报, 2017 吴文昊; 黄心宇; 姚锐敏; 陈人杰; 李凯; 邹如强收藏 \| 浏览/下载：4/0 \| 提交时间：2017/12/03 相变材料热能存储导热率碳泡沫电热转换 Phase change material Thermal energy storage Thermal conductivity Carbon foam Electro-to-heat energy conversion CONDUCTIVITY GRAPHENE
	OPTIMIZATION OF AGRICULTURAL INPUT EFFICIENCY FOR WHEAT PRODUCTION IN CHINA APPLYING DATA ENVELOPMENT ANALYSIS METHOD 期刊论文 APPLIED ECOLOGY AND ENVIRONMENTAL RESEARCH, 2017 Wang, N.; Jin, X.; Ye, S. T.; Gao, Y.; Li, X. F. 收藏 \| 浏览/下载：10/0 \| 提交时间：2017/12/03 environmental pollution input surplus agriculture technical efficiency farmer wheat production WINTER-WHEAT ENERGY-CONSUMPTION SOIL FERTILITY WATER-USE IRRIGATION YIELD MANAGEMENT CROP BENCHMARKING PROVINCE
	Hubbard interactions in iron-based pnictides and chalcogenides: Slater parametrization, screening channels, and frequency dependence 期刊论文 PHYSICAL REVIEW B, 2016 van Roekeghem, Ambroise; Vaugier, Loig; Jiang, Hong; Biermann, Silke 收藏 \| 浏览/下载：6/0 \| 提交时间：2017/12/03 MEAN-FIELD THEORY STRONGLY CORRELATED SYSTEMS ELECTRONIC-STRUCTURE PHOTOEMISSION-SPECTROSCOPY SUPERCONDUCTIVITY SPECTRA LIFEAS FESE GAP
	Critical Assessment of Time-Dependent Density Functional Theory for Excited States of Open-Shell Systems: II. Doublet-Quartet Transitions 期刊论文 JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2016 Li, Zhendong; Liu, Wenjian 收藏 \| 浏览/下载：6/0 \| 提交时间：2017/12/04 EXCHANGE-CORRELATION POTENTIALS EXCITATION-ENERGIES CONFIGURATION-INTERACTION MOLECULAR CALCULATIONS PROGRAM PACKAGE SIZE-CONSISTENT MODEL APPROXIMATION SPECTRA RADICALS
	Implementation issues and benchmarking of lattice Boltzmann method for moving rigid particle simulations in a viscous flow 期刊论文 11th ICMMES Conference, 2016 Peng, Cheng; Teng, Yihua; Hwang, Brian; Guo, Zhaoli; Wang, Lian-Ping 收藏 \| 浏览/下载：4/0 \| 提交时间：2017/12/03 Lattice Boltzmann method Interpolated bounce back Hydrodynamic force Galilean invariance Refilling FULLY RESOLVED SIMULATIONS NAVIER-STOKES EQUATION BOUNDARY-CONDITIONS PARTICULATE SUSPENSIONS GALILEAN INVARIANCE CURVED BOUNDARY BGK MODELS FLUID TURBULENCE DYNAMICS
	Alternative industrial carbon emissions benchmark based on input-output analysis 期刊论文 FRONTIERS OF EARTH SCIENCE, 2016 Han, Mengyao; Ji, Xi 收藏 \| 浏览/下载：6/0 \| 提交时间：2017/12/03 emissions trading scheme benchmarking carbon emissions input-output analysis EMBODIED ENERGY-CONSUMPTION CO2 EMISSIONS METHANE EMISSIONS TRADE IMBALANCE CHINA ECONOMY PERFORMANCE INVENTORY COST
	Embodied energy analysis for coal-based power generation system-highlighting the role of indirect energy cost 期刊论文 APPLIED ENERGY, 2016 Wu, X. D.; Xia, X. H.; Chen, G. Q.; Wu, X. F.; Chen, B. 收藏 \| 浏览/下载：2/0 \| 提交时间：2017/12/03 Coal-based power generation Embodied energy accounting Benchmark Indirect energy cost LIFE-CYCLE ASSESSMENT GREENHOUSE-GAS EMISSIONS WASTE-WATER TREATMENT MULTIOBJECTIVE OPTIMIZATION FOOTPRINT ASSESSMENT CARBON CAPTURE BIOGAS SYSTEM URBAN-ECONOMY CHINA PLANTS

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