Molecular Physics最新文献

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Symmetry-based method for the derivation of the vibration–rotation kinetic energy operator and energy levels calculation of carbonyl fluoride from a new ab initio potential energy surface 从新的 ab initio 势能面推导氟化碳振动旋转动能算子和能级计算的基于对称的方法
IF 1.7 4区 化学
Molecular Physics Pub Date : 2023-12-05 DOI: 10.1080/00268976.2023.2285029
Andrei V. Nikitin, A. Protasevich
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引用次数: 0
Heat and mass transport aspect on magnetised Jeffery fluid flow over a stretching cylinder with the Cattaneo–Christov heat flux model 利用卡塔尼奥-克里斯托夫热通量模型研究拉伸圆柱体上磁化杰弗里流体流动的热量和质量传输问题
IF 1.7 4区 化学
Molecular Physics Pub Date : 2023-12-05 DOI: 10.1080/00268976.2023.2288701
Rafi Ullah, M. Israr Ur Rehman, A. Hamid, Shazma Arooj, W. A. Khan
{"title":"Heat and mass transport aspect on magnetised Jeffery fluid flow over a stretching cylinder with the Cattaneo–Christov heat flux model","authors":"Rafi Ullah, M. Israr Ur Rehman, A. Hamid, Shazma Arooj, W. A. Khan","doi":"10.1080/00268976.2023.2288701","DOIUrl":"https://doi.org/10.1080/00268976.2023.2288701","url":null,"abstract":"","PeriodicalId":18817,"journal":{"name":"Molecular Physics","volume":"10 9","pages":""},"PeriodicalIF":1.7,"publicationDate":"2023-12-05","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"138601358","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Decision-making support: the impact of training on disability support workers who work with adults with cognitive disability. 决策支持:培训对从事认知障碍成人工作的残疾人支持工作者的影响。
IF 0.8 4区 化学
Molecular Physics Pub Date : 2023-12-01 Epub Date: 2022-05-27 DOI: 10.1017/BrImp.2022.14
Stella Koritsas
{"title":"Decision-making support: the impact of training on disability support workers who work with adults with cognitive disability.","authors":"Stella Koritsas","doi":"10.1017/BrImp.2022.14","DOIUrl":"10.1017/BrImp.2022.14","url":null,"abstract":"<p><p>There is growing recognition that people with disability have the right to be involved in making decisions that affect their lives. Decision-making support has emerged as one way to support people with cognitive disability to make decisions, however, there is a paucity of research that explores how disability support workers can be upskilled to provide decision-making support to this group. The aim of the research was to explore the impact of an evidence-based online training course on disability support workers of adults with cognitive disability. Changes in knowledge about decision-making support and confidence in providing decision-making support were explored, attitudes towards decision-making support, and facilitators and barriers. Participants completed an online training course and responded to a survey on three occasions: baseline, post-training, and at 2-month follow-up. Ninety-nine disability support workers across Australia participated in the online training and completed the baseline and post-training surveys. Thirty-six participants completed the training and all three surveys. The results revealed that there were statistically significant improvements in knowledge, confidence, and attitudes from baseline to post-training, which were maintained at 2-month follow-up. Barriers to decision-making support included service providers or other supporters, including the family of the person with cognitive disability, whilst a key enabler was knowing about the decision-making support principles. This research demonstrates that an evidence-based online training course about decision-making support can be effective in building capacity in disability support workers. There are, however, several barriers that must be addressed to facilitate the implementation of decision-making support.</p>","PeriodicalId":18817,"journal":{"name":"Molecular Physics","volume":"105 1","pages":"649-659"},"PeriodicalIF":0.8,"publicationDate":"2023-12-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"80863248","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
DFT study on adsorption of dissolved gas molecules in the transformer oil on Rh-doped MoTe 2 monolayer 变压器油中溶解气体分子在掺铑 MoTe 2 单层上吸附的 DFT 研究
IF 1.7 4区 化学
Molecular Physics Pub Date : 2023-11-30 DOI: 10.1080/00268976.2023.2287127
Weiquan Feng, Yu Zhang, Detao Lu, Jiaqi Zhang, W. Zeng, Qu Zhou
{"title":"DFT study on adsorption of dissolved gas molecules in the transformer oil on Rh-doped MoTe 2 monolayer","authors":"Weiquan Feng, Yu Zhang, Detao Lu, Jiaqi Zhang, W. Zeng, Qu Zhou","doi":"10.1080/00268976.2023.2287127","DOIUrl":"https://doi.org/10.1080/00268976.2023.2287127","url":null,"abstract":"","PeriodicalId":18817,"journal":{"name":"Molecular Physics","volume":"126 49","pages":""},"PeriodicalIF":1.7,"publicationDate":"2023-11-30","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"139197238","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Monte Carlo simulation of the planar discrete double layer for neutrally charged interfaces 中性带电界面平面离散双电层的蒙特卡罗模拟
IF 1.7 4区 化学
Molecular Physics Pub Date : 2023-11-30 DOI: 10.1080/00268976.2023.2288296
M. A. Chávez-Navarro, E. González-Tovar, M. Chávez-Páez
{"title":"Monte Carlo simulation of the planar discrete double layer for neutrally charged interfaces","authors":"M. A. Chávez-Navarro, E. González-Tovar, M. Chávez-Páez","doi":"10.1080/00268976.2023.2288296","DOIUrl":"https://doi.org/10.1080/00268976.2023.2288296","url":null,"abstract":"","PeriodicalId":18817,"journal":{"name":"Molecular Physics","volume":"209 ","pages":""},"PeriodicalIF":1.7,"publicationDate":"2023-11-30","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"139202749","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
New diabatic potential energy surfaces of KH 2 system constructed using neural network method 利用神经网络方法构建 KH 2 系统的新绝热势能面
IF 1.7 4区 化学
Molecular Physics Pub Date : 2023-11-30 DOI: 10.1080/00268976.2023.2287685
Xumin Zhao, Guojie Xie, Wentao Li, Yanxia Zhao, Cheng Yang
{"title":"New diabatic potential energy surfaces of KH 2 system constructed using neural network method","authors":"Xumin Zhao, Guojie Xie, Wentao Li, Yanxia Zhao, Cheng Yang","doi":"10.1080/00268976.2023.2287685","DOIUrl":"https://doi.org/10.1080/00268976.2023.2287685","url":null,"abstract":"","PeriodicalId":18817,"journal":{"name":"Molecular Physics","volume":"261 ","pages":""},"PeriodicalIF":1.7,"publicationDate":"2023-11-30","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"139203259","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Effects of substituted chalcogen atoms on excited state reaction for 1-(benzo[d]thiazol-2-yl)-6-substituted-naphthalen-2-ol derivatives 取代的绿原原子对 1-(苯并[d]噻唑-2-基)-6-取代萘-2-醇衍生物激发态反应的影响
IF 1.7 4区 化学
Molecular Physics Pub Date : 2023-11-29 DOI: 10.1080/00268976.2023.2288699
Chaozheng Li, Liang Yang, Hao Dong, Rivaille Liu
{"title":"Effects of substituted chalcogen atoms on excited state reaction for 1-(benzo[d]thiazol-2-yl)-6-substituted-naphthalen-2-ol derivatives","authors":"Chaozheng Li, Liang Yang, Hao Dong, Rivaille Liu","doi":"10.1080/00268976.2023.2288699","DOIUrl":"https://doi.org/10.1080/00268976.2023.2288699","url":null,"abstract":"","PeriodicalId":18817,"journal":{"name":"Molecular Physics","volume":"228 1","pages":""},"PeriodicalIF":1.7,"publicationDate":"2023-11-29","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"139210594","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Methane adsorption and dissociation mechanism on the WC(001) surface: a first-principle calculation WC(001) 表面的甲烷吸附和解离机制:第一原理计算
IF 1.7 4区 化学
Molecular Physics Pub Date : 2023-11-29 DOI: 10.1080/00268976.2023.2288300
Nan Gao, Zonghua Wang, Jingyi Xiao
{"title":"Methane adsorption and dissociation mechanism on the WC(001) surface: a first-principle calculation","authors":"Nan Gao, Zonghua Wang, Jingyi Xiao","doi":"10.1080/00268976.2023.2288300","DOIUrl":"https://doi.org/10.1080/00268976.2023.2288300","url":null,"abstract":"","PeriodicalId":18817,"journal":{"name":"Molecular Physics","volume":"12 1","pages":""},"PeriodicalIF":1.7,"publicationDate":"2023-11-29","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"139209815","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Exact solutions for shock waves in polyatomic dilute gases 多原子稀释气体中冲击波的精确解
IF 1.7 4区 化学
Molecular Physics Pub Date : 2023-11-28 DOI: 10.1080/00268976.2023.2281598
R. M. Velasco, W. Marques Jr, F. Uribe
{"title":"Exact solutions for shock waves in polyatomic dilute gases","authors":"R. M. Velasco, W. Marques Jr, F. Uribe","doi":"10.1080/00268976.2023.2281598","DOIUrl":"https://doi.org/10.1080/00268976.2023.2281598","url":null,"abstract":"","PeriodicalId":18817,"journal":{"name":"Molecular Physics","volume":"48 1","pages":""},"PeriodicalIF":1.7,"publicationDate":"2023-11-28","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"139220289","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Enlightening salt: enthalpy of formation of gaseous sodium chloride by photoelectron photoion coincidence spectroscopy 启迪之盐:通过光电子光子重合光谱分析气态氯化钠的形成焓
IF 1.7 4区 化学
Molecular Physics Pub Date : 2023-11-28 DOI: 10.1080/00268976.2023.2286308
Xiangkun Wu, P. Hemberger, A. Bodi
{"title":"Enlightening salt: enthalpy of formation of gaseous sodium chloride by photoelectron photoion coincidence spectroscopy","authors":"Xiangkun Wu, P. Hemberger, A. Bodi","doi":"10.1080/00268976.2023.2286308","DOIUrl":"https://doi.org/10.1080/00268976.2023.2286308","url":null,"abstract":"","PeriodicalId":18817,"journal":{"name":"Molecular Physics","volume":"1 1","pages":""},"PeriodicalIF":1.7,"publicationDate":"2023-11-28","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"139219408","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
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