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	Crystal Structure and Some Thermodynamic Properties of Ca7MgSi4O16-Bredigite 期刊论文 OAI收割 CRYSTALS, 2021, 卷号: 11, 期号: 1, 页码: 14 作者: Bao, Xinjian; He, Mingyue; Zhang, Zhigang; Liu, Xi \| 收藏 \| 浏览/下载：88/0 \| 提交时间：2021/10/08 bredigite single-crystal XRD structure refinement first-principle calculation compressibility heat capacity standard vibrational entropy
	A new Ca3MgSi2O8 compound and some of its thermodynamic properties 期刊论文 OAI收割 JOURNAL OF SOLID STATE CHEMISTRY, 2017, 卷号: 255, 页码: 145-149 作者: Bao, Xinjian; Zhang, Yanyao; Zhang, Zhigang; Zhang, Lifei; Liu, Xiaoyang \| 收藏 \| 浏览/下载：24/0 \| 提交时间：2017/11/24 New Ca3MgSi2Os compound Single-crystal X-ray diffraction First-principles simulation Compressibility Heat capacity Standard vibrational entropy
	Some thermodynamic properties of larnite (beta-Ca2SiO4) constrained by high TIP experiment and/or theoretical simulation 期刊论文 OAI收割 AMERICAN MINERALOGIST, 2016, 卷号: 101, 期号: 1-2, 页码: 277-288 作者: Xiong, Zhihua; Liu, Xi; Shieh, Sean R.; Wang, Sicheng; Chang, Linlin \| 收藏 \| 浏览/下载：22/0 \| 提交时间：2017/11/27 beta-Ca2SiO4 compressibility entropy heat capacity larnite thermal expansivity thermal Grilneisen parameter thermodynamic property
	Microhydrated dihydrogen phosphate clusters probed by gas phase vibrational spectroscopy and first principles calculations 期刊论文 OAI收割 physical chemistry chemical physics, 2015, 卷号: 17, 期号: 39, 页码: 25714-25724 作者: Sun, Shou-Tian; Jiang, Ling; Liu, J. W.; Heine, Nadja; Yacovitch, Tara I. 收藏 \| 浏览/下载：18/0 \| 提交时间：2015/11/17
	Fast and Accurate Computation Schemes for Evaluating Vibrational Entropy of Proteins 期刊论文 OAI收割 journal of computational chemistry, 2011, 卷号: 32, 期号: 15, 页码: 3188-3193 作者: Xu, Beisi; Shen, Hujun; Zhu, Xiao; Li, Guohui 收藏 \| 浏览/下载：17/0 \| 提交时间：2015/11/12 normal mode analysis vibrational entropy coarse-grained NMA