Di Wu

Overview

Best Publications

• The structure and the large nonlinear optical properties of Li@calix[4]pyrrole.

  Wei Chen;Zhi-Ru Li;Di Wu;Ying Li

  355
  Citations

• Structures and large NLO responses of new electrides: Li-doped fluorocarbon chain.

  Hong Liang Xu;Zhi Ru Li;Di Wu;Bing Qiang Wang

  294
  Citations

• Nonlinear optical properties of alkalides Li+(calix[4]pyrrole) M- (M = Li, Na, and K): Alkali anion atomic number dependence

  Wei Chen;Zhi Ru Li;Di Wu;Ying Li

  241
  Citations

• Compounds of Superatom Clusters: Preferred Structures and Significant Nonlinear Optical Properties of the BLi6-X (X = F, LiF2, BeF3, BF4) Motifs

  Ying Li;Di Wu;Zhi-Ru Li

  185
  Citations

• Structures and considerable static first hyperpolarizabilities: new organic alkalides (M+@n6adz)M'- (M, M'=Li, Na, K; n=2, 3) with cation inside and anion outside of the cage complexants.

  Fang Fang Wang;Zhi Ru Li;Di Wu;Bing Qiang Wang

  164
  Citations

• An ab Initio Prediction of the Extraordinary Static First Hyperpolarizability for the Electron-Solvated Cluster (FH)2{e}(HF)

  Ying Li;Zhi-Ru Li;Di Wu;Rui-Yan Li

  159
  Citations

• Theoretical investigation of the large nonlinear optical properties of (HCN)n clusters with Li atom.

  Wei Chen;Zhi-Ru Li;Di Wu;Rui-Yan Li

  150
  Citations

• Large static first and second hyperpolarizabilities dominated by excess electron transition for radical ion pair salts M2˙+TCNQ˙− (M = Li, Na, K)

  Zong Jun Li;Fang Fang Wang;Zhi Ru Li;Hong Liang Xu

  146
  Citations

• On the potential application of superalkali clusters in designing novel alkalides with large nonlinear optical properties.

  Wei-Ming Sun;Li-Tao Fan;Ying Li;Jia-Yuan Liu

  146
  Citations

• The interaction between superalkalis (M3O, M = Na, K) and a C20F20 cage forming superalkali electride salt molecules with excess electrons inside the C20F20 cage: dramatic superalkali effect on the nonlinear optical property

  Jia-Jun Wang;Jia-Jun Wang;Zhong-Jun Zhou;Yang Bai;Zhen-Bo Liu

  139
  Citations

• The static polarizability and first hyperpolarizability of the water trimer anion: ab initio study.

  Wei Chen;Zhi-Ru Li;Di Wu;Feng-Long Gu

  126
  Citations

• A Solution-Processable Donor–Acceptor Compound Containing Boron(III) Centers for Small-Molecule-Based High-Performance Ternary Electronic Memory Devices†

  Chun-Ting Poon;Di Wu;Wai Han Lam;Vivian Wing-Wah Yam

  123
  Citations

• Modulated Nonlinear Optical Responses and Charge Transfer Transition in Endohedral Fullerene Dimers Na@C60C60@F with n-Fold Covalent Bond (n = 1, 2, 5, and 6) and Long Range Ion Bond

  Fang Ma;Zhi-Ru Li;Zhong-Jun Zhou;Di Wu

  123
  Citations

• A theoretical study on superalkali-doped nanocages: unique inorganic electrides with high stability, deep-ultraviolet transparency, and a considerable nonlinear optical response.

  Wei-Ming Sun;Xiang-Hui Li;Di Wu;Ying Li

  116
  Citations

• New Acceptor–Bridge–Donor Strategy for Enhancing NLO Response with Long-Range Excess Electron Transfer from the NH2...M/M3O Donor (M = Li, Na, K) to Inside the Electron Hole Cage C20F19 Acceptor through the Unusual σ Chain Bridge (CH2)4

  Yang Bai;Zhong-Jun Zhou;Jia-Jun Wang;Jia-Jun Wang;Ying Li

  115
  Citations

• Do single-electron lithium bonds exist? Prediction and characterization of the H3C...Li-Y (Y=H, F, OH, CN, NC, and CCH) complexes.

  Ying Li;Di Wu;Zhi-Ru Li;Wei Chen

  114
  Citations

• Low ionization potentials of binuclear superalkali B2Li11

  Jing Tong;Ying Li;Di Wu;Zhi-Ru Li

  113
  Citations

• Lithiation and Li-Doped Effects of [5]Cyclacene on the Static First Hyperpolarizability

  Hong-Liang Xu;Zhi Ru Li;Di Wu;Fang Ma

  105
  Citations

• Organic memory devices based on a bis-cyclometalated alkynylgold(III) complex

  Vonika Ka-Man Au;Di Wu;Vivian Wing-Wah Yam

  104
  Citations

• Simple synthesis method of Bi2S3/CdS quantum dots cosensitized TiO2 nanotubes array with enhanced photoelectrochemical and photocatalytic activity

  Pin Lv;Wuyou Fu;Haibin Yang;Hairui Sun

  104
  Citations

• Ab Initio Investigation on a New Class of Binuclear Superalkali Cations M2Li2k+1+ (F2Li3+, O2Li5+, N2Li7+, and C2Li9+)

  Jing Tong;Ying Li;Di Wu;Zhi-Ru Li

  104
  Citations

• Inverse Sodium Hydride: Density Functional Theory Study of the Large Nonlinear Optical Properties

  Wei Chen;Zhi-Ru Li;Di Wu;Ying Li

  101
  Citations

• Structural properties and nonlinear optical responses of superatom compounds BF4‐M (M = Li, FLi2, OLi3, NLi4)

  Hui Yang;Ying Li;Di Wu;Zhi-ru Li

  100
  Citations

• Compounds of Superatom Clusters: Preferred Structures and Significant Nonlinear Optical Properties of the BLi6X (X: F, LiF2, BeF3, BF4) Motifs.

  Ying Li;Di Wu;Zhi‐Ru Li

  0
  Citations