分子晶体

分子晶体RbC8H5O4的振动模对称化分析和喇曼光谱研究

Symmetrization analysis of vibrational modes and study of Raman spectra for molecular crystal rbc_8h_5o

一维反铁磁分子晶体NENP中的孤立子激发

Solitary excitation in 1 D antiferromagnetic molecular crystal nenp

离子辐照聚乙烯合成小于C（60）的富勒烯分子晶体

Synthesis of fullerene crystals smaller than c_ ( 60 ) by ion beam irradiation of polyethylene

瓜环[2]准轮烷分子晶体结构及切割DNA研究

Crystal Structure and DNA Cleavage of [ 2 ] Pseudorotaxane Composed of Cucurbit [ 6 ] uril

分子晶体的高压Raman光谱及结构相变

High-pressure Raman spectra and structure phase transition for molecule crystals

在准一维有机分子晶体中由超声孤子引起的Mossbauer效应

Mossbauer effect resulting from supersonic solitons in quasi-one-dimensional organic molecular crystals

草药牛筋果化学成分的研究IV牛晶V的分子晶体结构

Studies on chemical constituents of the Chinese medicine niu-jin-guo ( harrisonta perforate Blanco merr . ) IV. Ihe molecular and crystal structure on niu-jing V

综述了分子晶体从头算（密度范函和Hartree-Fock方法）和相关半经验方法的理论研究工作。

The previous theoretical works on molecular crystals using ab initio methods ( density functional theory , Hartree-Fock methods ) and related semi-empirical methods have been reviewed .

在此基础之上，进一步探索其他小富勒烯分子晶体（如C32，C38和C24）存在的确凿证据。

Based on this we are now trying to find evidence for the existence of other small fullerenes , such as C 24 , C 32 , and C 38 .

有机分子晶体的从头算研究

Ab Initio Studies of Organic Molecular Crystals : a Literature Review

一个计算有机分子晶体密度的经验公式&兼述高密度有机晶体设计的两条途径

An Empirical Approach to the Evaluation of Organic Crystal Density

有机分子晶体及钕掺杂的钒酸钇晶体的高压研究

High Pressure Study of Organic Molecular Crystals and Nd : YVO_4 Crystal

苯衍生物分子晶体的倍频效应规律的探讨

Investigation of regularity of frequency doubling effect in benzene derivative molecular crystals

双原子分子晶体体系振动弛豫的温度效应

Temperature effect of vibrational relaxation for diatomic molecular crystal

分子晶体电子能带的结构特征

Structure characteristics of electronic energy bands about molecular crystal

分子晶体的电子态密度计算与应用

Calculations of the electronic density of States and its applications for molecular crystals

有机分子晶体中的激子与载流子传输

Molecular selection exciton and carrier transportation in organic crystalline

分子晶体萘中超声二次谐波的测量

Measurements of ultrasonic harmonics in molecular crystal naphthalene

在线性型分子晶体中的局域性集体激发特性

Properties of Localized Excitation in Linear Molecular Crystals

生物大分子晶体生长机理的研究面临极好的发展机遇。

The growth mechanism of macromolecular crystals in faced with a wonderful developing opportunity .

拉曼峰强作为分子晶体相变的有序度

The Raman intensity as the order parameter of the phase transition for molecular crystals

分子晶体马来酸氢十六酯的形貌分析

Morphology Analysis of Molecule Crystal-Hexadecyl Hydrogen Maleate

一维分子晶体的极化子-孤立子运动

Polaron Solitons Motion in One-dimensional Molecular Crystals

概述了常压下分子晶体的晶体结构、晶格能、电子键结构等晶体性质。

The crystal structures , lattice energies and electronic band structures at ambient condition are summarized .

分子晶体中的几种分子间相互作用

Some Intermolecular Interactions of Molecular Crystals

也讨论了流体静压力和单轴压力下分子晶体高压行为的研究结果。

The high-pressure behaviors of the molecular crystals under hydrostatic and uniaxial compressions from previous works are also discussed .

为有机小分子晶体的形貌控制提供了新的思路。

Therefore , a new approach has been developed to control the morphology of small molecular weight organic materials .

第二章用解析方法研究一维分子晶体电子-声子耦合系统基态中晶格非线性效应。

In chapter two we analytically study the nonlinear lattice effects for the ground state of electron-phonon interaction one-dimensional molecular crystal system .

提供了一种解决分子晶体量子化学理论计算的新思路。

The present work provides a useful way to deal with quantum chemistry calculations of the kind of molecular crystals like urea .

本文把固体物理学中的电子态密度概念推广到分子晶体的电子结构研究。

The concept of electronic density of states in Solid State Physics has been extended to study of electronic structure of molecular crystal .