高等学校化学学报
高等學校化學學報
고등학교화학학보
CHEMICAL JOURNAL OF CHINESE UNIVERSITIES
2014年
12期
2523-2528
,共6页
戚克振%王艳%付嘉琦%Rengaraj Selvaraj%王贵昌
慼剋振%王豔%付嘉琦%Rengaraj Selvaraj%王貴昌
척극진%왕염%부가기%Rengaraj Selvaraj%왕귀창
硫化铟纳米花%液相合成%密度泛函理论%表面能%形貌控制
硫化銦納米花%液相閤成%密度汎函理論%錶麵能%形貌控製
류화인납미화%액상합성%밀도범함이론%표면능%형모공제
In2 S3 nanoflowers%Solution-based synthesis%Density functional theory%Surface energy%Morpho-logy control
以C2 H5 NS和In( NO3)3为前驱物,采用简单的液相法成功制备了In2 S3纳米多级结构, C2 H5 NS作为硫源的同时也起到了模板剂的作用.研究结果表明,前驱物浓度对 In2 S3形貌控制起着重要作用.随着In(NO3)3/C2H5NS 摩尔比从1颐1.5增加到1颐6, In2S3纳米花呈现了不同的形貌和尺寸. XRD谱图显示, In2 S3纳米花晶体具有立方结构. SEM和TEM照片显示,制备的In2 S3纳米结构呈多级花状结构,这种结构由纳米片堆积组装而成.通过第一性原理计算并结合实验结果对C2 H5 NS影响纳米片生长的机理进行了分析,结果表明C2 H5 NS在In2 S3(001)晶面上的吸附可以有效降低晶面的表面能,起到稳定晶面的作用;纳米花的形成是在C2 H5 NS影响In2 S3的晶面稳定性及其成核速率之间的一个协同效应. In2 S3纳米晶的形貌可以通过调整反应溶液中的C2 H5 NS浓度来调节.
以C2 H5 NS和In( NO3)3為前驅物,採用簡單的液相法成功製備瞭In2 S3納米多級結構, C2 H5 NS作為硫源的同時也起到瞭模闆劑的作用.研究結果錶明,前驅物濃度對 In2 S3形貌控製起著重要作用.隨著In(NO3)3/C2H5NS 摩爾比從1頤1.5增加到1頤6, In2S3納米花呈現瞭不同的形貌和呎吋. XRD譜圖顯示, In2 S3納米花晶體具有立方結構. SEM和TEM照片顯示,製備的In2 S3納米結構呈多級花狀結構,這種結構由納米片堆積組裝而成.通過第一性原理計算併結閤實驗結果對C2 H5 NS影響納米片生長的機理進行瞭分析,結果錶明C2 H5 NS在In2 S3(001)晶麵上的吸附可以有效降低晶麵的錶麵能,起到穩定晶麵的作用;納米花的形成是在C2 H5 NS影響In2 S3的晶麵穩定性及其成覈速率之間的一箇協同效應. In2 S3納米晶的形貌可以通過調整反應溶液中的C2 H5 NS濃度來調節.
이C2 H5 NS화In( NO3)3위전구물,채용간단적액상법성공제비료In2 S3납미다급결구, C2 H5 NS작위류원적동시야기도료모판제적작용.연구결과표명,전구물농도대 In2 S3형모공제기착중요작용.수착In(NO3)3/C2H5NS 마이비종1이1.5증가도1이6, In2S3납미화정현료불동적형모화척촌. XRD보도현시, In2 S3납미화정체구유립방결구. SEM화TEM조편현시,제비적In2 S3납미결구정다급화상결구,저충결구유납미편퇴적조장이성.통과제일성원리계산병결합실험결과대C2 H5 NS영향납미편생장적궤리진행료분석,결과표명C2 H5 NS재In2 S3(001)정면상적흡부가이유효강저정면적표면능,기도은정정면적작용;납미화적형성시재C2 H5 NS영향In2 S3적정면은정성급기성핵속솔지간적일개협동효응. In2 S3납미정적형모가이통과조정반응용액중적C2 H5 NS농도래조절.
Flower-like In2 S3 hierarchical nanostructures were successfully prepared via a facile solution-phase route, using In( NO3 ) 3 as processor and C2 H5 NS as sulfur source. Our experimental results demonstrated that the morphology of the product can be easily modified by tuning the precursor ratio. The molar ratio of In( NO3 ) 3/C2 H5 NS plays a crucial role in the morphology of In2 S3 hierarchitectures. With the ratio increasing from 1:1. 5 to 1:6, the flower-like In2 S3 crystals exhibited various morphologies and different sizes. X-ray diffraction( XRD) patterns of the flowers revealed the cubic structure of In2 S3;morphological studies examined by scanning electron microscope( SEM) and transmission electron microscope( TEM) showed that the synthe-sized In2 S3 nanostructure was flower-like hierarchitecture assembled by nanoflakes. Density functional theory ( DFT) calculation results indicate that the adsorption of C2 H5 NS can affectively and selectively reduce the surface energy of In2 S3 facet, stabilize the corresponding crystal facet. The results indicate that there is a syn-ergistic effect between C2 H5 NS protecting the crystal facet and the nucleation rate for C2 H5 NS to tune the growth of In2 S3 nanoplates. Therefore, the morphology of flower-like In2 S3 crystals can be controlled by adjus-ting the C2 H5 NS concentration in the mixed solvent.