화학공학소재연구정보센터
검색결과 : 10건
No. Article
1 A Theoretical Approach for Accurate Predictions of the Enthalpies of Formation of Carotenes
Lii JH, Liao FX, Hsieh HY, Hu CH
Journal of Physical Chemistry A, 114(46), 12334, 2010
2 The Important Role of Lone-Pairs in Force Field (MM4) Calculations on Hydrogen Bonding in Alcohols
Lii JH, Allinger NL
Journal of Physical Chemistry A, 112(46), 11903, 2008
3 Molecular mechanics (MM4) study of fluorinated hydrocarbons
Chen KH, Lii JH, Walker GA, Xie YM, Schaefer HF, Allinger NL
Journal of Physical Chemistry A, 110(22), 7202, 2006
4 Alcohols, ethers, carbohydrates, and related compounds part V. The Bohlmann torsional effect
Lii JH, Chen KH, Allinger NL
Journal of Physical Chemistry A, 108(15), 3006, 2004
5 Molecular mechanics (MM4) calculations on [3.3]- and [4.4]orthoparacyclophanes
Sakakibara K, Naka K, Yamaguchi Y, Asami M, Chen KH, Lii JH, Allinger NL
Journal of Physical Chemistry A, 108(15), 3048, 2004
6 Molecular mechanics (MM4) studies of carboxylic acids, esters, and lactones
Lii JH
Journal of Physical Chemistry A, 106(37), 8667, 2002
7 A Molecular Mechanics Study of the Cholesteryl Acetate Crystal - Evaluation of Interconversion Among R(G), R(Z), and R(Alpha) Bond Lengths
Ma BY, Lii JH, Chen KS, Allinger NL
Journal of the American Chemical Society, 119(10), 2570, 1997
8 Systematic Comparison of Experimental, Quantum-Mechanical, and Molecular Mechanical Bond Lengths for Organic-Molecules
Ma BY, Lii JH, Schaefer HF, Allinger NL
Journal of Physical Chemistry, 100(21), 8763, 1996
9 Quantum-Mechanical and Molecular Mechanics (MM3) Studies of Hydrazines
Ma BY, Lii JH, Chen KS, Allinger NL
Journal of Physical Chemistry, 100(27), 11297, 1996
10 Molecular Mechanics Explanation of the Metallocene Bent Sandwich Structure
Timofeeva TV, Lii JH, Allinger NL
Journal of the American Chemical Society, 117(28), 7452, 1995