部分电离稠密氦等离子体物态方程的自洽变分计算

稠密氦在高温高压下将会发生电离, 电离能会因为原子、离子以及电子之间的相互作用而降低. 考虑He，He⁺，He²⁺，e之间的相互作用, 通过粒子化学势平衡得到非理想的电离平衡方程，用自洽流体变分过程对方程求解, 进而对自由能求导获得体系的热力学状态参量. 模型计算结果与已有的实验和理论计算相一致. 用此模型预测密度10^-3—10^0.3 g/cm³和温度4—7 eV范围的物态方程, 获得了压力在500　GPa以内的理论数据. 计算表明粒子间的非理想相互作用引起的电离能降低是出现压致电离现象的主要原因，在高温高密度物态方程的计算中必须考虑粒子间非理想相互作用对电离能修正的影响. 关键词： 氦 物态方程 部分电离等离子体 自洽变分     

利用不同原子模型计算局部热力学平衡等离子体电离态(英文)

等离子体电离态分布是等离子体物理学中被广泛应用的重要物理量之一,而原子数据是电离态计算的前提.首先,利用Rubiano相对论性原子结构模型、Faussurier非相对论原子结构模型和高度简化的More模型,分别计算各种电离度的Fe离子能量.通过与自洽场结果的比较后认为,Faussurier模型给出的原子数据比较精确可靠.然后,再利用以上模型研究了局部热力学平衡Fe等离子体电离态随温度和密度的变化情况.计算结果表明,不同原子模型提供的原子数据对平均电离度的计算结果影响不大,但明显地影响等离子体中的离子丰度.本文对这些差异进行了物理分析.     

Identification of Intermediates in Pyridine Pyrolysis with Molecular-beam Mass Spectrometry and Tunable Synchrotron VUV Photoionization

利用可调谐同步辐射真空紫外光电离结合分子束取样技术研究吡啶的热解,温度是1255―1765 K、压力为267 Pa. 通过测量光电离质谱和光电离效率谱,鉴别了近20种产物和中间物,并给出了物种随温度变化的摩尔分数. 主要的产物为H2、HCN、C2H2、C5H3N、C4H2和C3H3N. 根据实验结果分析了吡啶热解的一些主要反应路径.     

半掺杂钙钛矿Pr_(0.5)Sr_(0.5)CoO_3中磁熵变的标度律研究

对半掺杂氧化钴Pr0.5Sr0.5Co O3在居里温度(TC≈232 K)附近的磁熵变(ΔSM)进行了研究.研究表明,磁熵变的最大值(ΔSmaxM)依赖于外磁场强度(H):ΔSmaxM~Hn,其中n=0.55±0.14;半高宽(δTFWHM)与H有如下关系:δTFWHM~H0.4±0.1;而相对制冷能力(RCP)与H几乎呈线性关系.另外,在不同的温度和磁场强度下测得的磁熵变(ΔSM(T,H))能够重新标度为一条普适的曲线.依据该唯象的普适曲线,能够较准确的计算出在不同温度和磁场强度下磁熵变的大小.     

(e,2e)反应三重微分截面的计算

给出了利用BBK模型计算电子碰撞电离H,He⁺,He和Li⁺三重微分截面的通用方法,适用于中、高入射能量下的各种几何条件。计算结果与其它理论结果和实验数据进行了比较,符合得很好。     

气体临界温度以上吸附平衡的预测研究

采用容积法测定了CH4和N2 在微孔活性炭K0 2上的吸附平衡数据 ,温度为 2 73～ 333K ,压力为 0～12MPa .提出了一个可以从单一气体吸附等温线预测其它条件下吸附平衡的理论模型 .该模型考虑了临界温度以上吸附相密度和饱和吸附量与温度的关系 ,并采用孔径分布来表征吸附剂表面吸附势场的不均一性 ,局部方程使用Langmuir描述 .利用此模型预测了CH4和N2 在K0 2活性炭上的吸附平衡 ,在所研究的温度、压力范围内的整体预测偏差不超过 3% .另外 ,对文献中不同实验条件下气体临界温度以上的吸附平衡进行了研究 ,在较宽的范围内也取得了很好的预测结果     

532nm丙酮和丁酮多光子电离解离研究

利用激光质谱法,通过分析丙酮和丁酮的多光子电离飞行时间质谱,对其532nm多光子电离机制进行了研究. 结果发现丙酮相干吸收若干光子跃迁到高能超激发态,再继续吸收光子产生各种碎片离子,而丁酮先解离后电离. 两质谱中都有质荷比为4、6、8的离子,原则上是高价离子,但在相似条件下未见相关报道,因此对离子出险原因及确认尚待进一步研究. 实验中丁酮发生异构现象,其异构体电离解离出较强的C2H3O+(m/e=43).丙酮没有相关离子产生.     

强扰动区C~(q+)离子与He原子碰撞中有效电荷研究

本文利用经典过垒电离模型(Class Over Barrier Ionization)处理100-400ke V/amu强扰动区(q/v1)的不同价态非全裸离子Cq+(q=1-4)与全裸离子H1+,He2+,Li3+与He原子碰撞过程.发现相同价态下,全裸离子的双单电离截面比R21明显低于非全裸离子,原因在于两者的电子结构明显不同.非全裸离子的外壳层电子在碰撞过程中会有一定几率过垒,这在以往的研究中并未考虑.利用模型计算结果与实验数据的比对,估计入射离子第二有效电荷,最终确定入射离子在电离过程中的第一和第二有效电荷.     

532nm丙酮和丁酮的多光子电离解离研究

利用激光质谱法,通过分析丙酮和丁酮的多光子电离飞行时间质谱,对其532 nm多光子电离机制进行了研究.结果发现丙酮相干吸收若干光子跃迁到高能超激发态,再继续吸收光子产生各种碎片离子,而丁酮先解离后电离,两质谱中都有质荷比为4、6、8的离子,原则上是高价离子.但在相似条件下未见相关报道,因此对离子出险原因及确认尚待进一步研究,实验中丁酮发生异构现象,其异构体电离解离出较强的C2H3O (m/e=43).丙酮没有相关离子产生.     

金等离子体平均离化度随电子温度变化关系的研究

用Cowan的原子结构从头算程序和自旋轨道劈裂阵模型计算各阶电离的金离子能级和跃迁， 在碰撞辐射模型下求解能级布居数方程，计算给定等离子体密度和电子温度下等离子体中离子的分布，给出了平均离化度随电子温度的变化关系.发现稀薄的金等离子体中，在一定的电子温度范围内电子温度的升高平均电离度反而下降的反常现象.讨论了电离势对平均离化度的影响. 关键词： 金等离子体 碰撞辐射模型 布居数 平均电离度     

Pressure-induced phase transition(s) in KMnF3 and the importance of the excess volume for phase transitions in perovskite structures

We report a pressure-dependent investigation of KMnF(3) by x-ray diffraction up to 30 GPa. The results are discussed in the framework of Landau theory and in relation to the isostructural phase transition in SrTiO(3). The phase transition temperature near 186 K in KMnF(3) shifts to room temperature at a critical pressure of P(c) = 3.4 GPa; the pressure dependence of the transition point follows ΔP(c)/ΔT(c) = 0.0315 GPa K(-1). The transition becomes second order under high pressure, close to the tricritical point. The phase transition is determined by the rotation of MnF(6) octahedra with their simultaneous expansion along the rotation axis. The rotation angle was found to increase to 10.5° at 24 GPa. An additional anomaly was observed at higher pressure around 25 GPa, suggesting a further phase transition.     

Neutron enhancement from laser interaction with a critical fluid

We discuss experimentally and theoretically neutron production from the laser driven explosion of gas clusters prepared near the liquid-gas critical point. We let deuterated methane that was prepared very close to its critical temperature and pressure expand through a conical nozzle to create clusters, and then irradiated those clusters with a high intensity pulse from the Texas Petawatt Laser. After ionization, the clusters explode producing energetic ions, some of which fuse with resultant neutron emission. We show that the critical fluctuations present in the nozzle before the expansion influence the dynamics of neutron production. Neutron production near the critical point follows a power law, which is a signature of a second order phase transition and it is consistent with the Fisher model. This result might be relevant for energy production from fusion reactions.     

Critical point for the S → M transition in SmS

The critical point for the isostructural black to metallic phase transition in SmS has been determined using thermoelectric power as a probe. The magnitude of the thermo-power anomaly accompanying this electronic phase transition continuously decreases with the increase of temperature. Further the pressure hysteresis between the forward and reverse transitions progressively decreases as the critical point is approached. The present study indicates that the critical point is close to 825°C.     

Mott transition, antiferromagnetism, and unconventional superconductivity in layered organic superconductors

The phase diagram of the organic superconductor kappa-(ET)2Cu[N(CN)2]Cl has been accurately measured from 1H NMR and ac susceptibility techniques under helium gas pressure. The domains of stability of antiferromagnetic and superconducting orders in the pressure vs temperature plane have been determined. Both phases overlap through a first-order boundary that separates two regions of inhomogeneous phase coexistence. The boundary curve merges with the first-order line of the metal-insulator transition which ends with a critical point at higher temperature. The whole phase diagram features a point-like region where metallic, insulating, antiferromagnetic, and non-s-wave superconducting phases all meet.     

一簇金刚石晶格上S~4模型的相变

采用重整化群和累积展开的方法,研究了一簇金刚石晶格上S~4模型的相变,求得了系统的临界点.结果表明:当分支数m=2和m 12时,该系统只存在一个Gauss不动点K~*=b_2/2, u_2~*=0;当分支数3≤m≤12时,该系统不仅有Gauss不动点,还存在一个Wilson-Fisher不动点,并且后一个不动点对系统的临界特性产生决定性的影响.     

The Equation of State and Phase Structure in A Model with Dynamical Spontaneous Symmetry Breaking at Finite Temperature and Density

Based on the Lurie model,a convenient scheme is constructed for calculating the equation of state approximately.The parametric equaion of state is given in the Lurie model.The phase diagram of the model shows the existence of critical point separating first order from second order chiral phase transition.The careful analysis of isotherms of pressure versus net baryon number density suggests the existence of overheat and overcool metastable state and the coexistence of broken phase and normal phase.     

Tricritical point and wing structure in the itinerant ferromagnet UGe₂

Precise resistivity measurements on the ferromagnetic superconductor UGe2 under pressure p and magnetic field H reveal a previously unobserved change of the anomaly at the Curie temperature. Therefore, the tricritical point (TCP) where the paramagnetic-to-ferromagnetic transition changes from a second order to a first order transition is located in the p-T phase diagram. Moreover, the evolution of the TCP can be followed under the magnetic field in the same way. It is the first report of the boundary of the first order plane which appears in the p-T-H phase diagram of weak itinerant ferromagnets. This line of critical points starts from the TCP and will terminate at a quantum critical point. These measurements provide the first estimation of the location of the quantum critical point in the p-H plane and will inspire similar studies of the other weak itinerant ferromagnets.     

On the implementation of the coexistence phase of antiferromagnetism and superconductivity in heavy-fermion intermetallides

The region of the state diagram in which the pressure-induced quantum phase transition occurs with the destruction of the antiferromagnetic ordering and the appearance of the superconductivity has been described within the periodic Anderson model. It has been shown that a microscopically homogeneous coexistence phase of antiferromagnetism and superconductivity is implemented in the vicinity of the critical point, which was experimentally found in the heavy-fermion compound CeRhIn₅. In this region, the pressure increase is accompanied by the experimentally observed strong growth of the effective fermion mass.     

Low temperature magnetism in the rare-earth perovskite GdScO_3

The magnetic phase diagram of rare-earth perovskite compound, GdScO_3, has been investigated by magnetization and heat capacity. The system undergoes an antiferromagnetic phase transition at T_N= 2.6K, with an easy axis of magnetization along the a axis. The magnetization measurements show that it exists a spin-flop transition around 0.3 T for the applied field along the a axis. The critical magnetic field for the antiferromagnetic-to-paramagnetic transition is near 3.2 T when temperature approaches zero. By scaling susceptibilities, we presume this point(B = 3.2 T, T = 0 K) might be a fieldinduced quantum critical point and the magnetic critical fluctuations can even be felt above TN.     

Anomalous properties and coexistence of antiferromagnetism and superconductivity near a quantum critical point in rare-earth intermetallides

Mechanisms of the appearance of anomalous properties experimentally observed at the transition through the quantum critical point in rare-earth intermetallides have been studied. Quantum phase transitions are induced by the external pressure and are manifested as the destruction of the long-range antiferromagnetic order at zero temperature. The suppression of the long-range order is accompanied by an increase in the area of the Fermi surface, and the effective electron mass is strongly renormalized near the quantum critical point. It has been shown that such a renormalization is due to the reconstruction of the quasiparticle band, which is responsible for the formation of heavy fermions. It has been established that these features hold when the coexistence phase of antiferromagnetism and superconductivity is implemented near the quantum critical point.