THE SENSITIVITY OF THE INTERMOLECULAR POTENTIAL TO A VARIATION OF THE POTENTIAL PARAMETERS - THE QUADRUPOLE-MOMENT AS AN EXAMPLE

被引:15
作者
BOHM, HJ
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10.1080/00268978500102381
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O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
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页码:375 / 383
页数:9
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共 26 条
[1]   THE QUADRUPOLE-MOMENTS OF CARBON-DIOXIDE AND CARBON-DISULFIDE [J].
BATTAGLIA, MR ;
BUCKINGHAM, AD ;
NEUMARK, DM ;
PIERENS, RK ;
WILLIAMS, JH .
MOLECULAR PHYSICS, 1981, 43 (05) :1015-1020
[2]   RAYLEIGH-SCATTERING DEPOLARIZATION RATIO AND MOLECULAR POLARIZABILITY ANISOTROPY FOR GASES [J].
BOGAARD, MP ;
BUCKINGHAM, AD ;
PIERENS, RK ;
WHITE, AH .
JOURNAL OF THE CHEMICAL SOCIETY-FARADAY TRANSACTIONS I, 1978, 74 :3008-3015
[3]   A STUDY OF SHORT-RANGE REPULSIONS [J].
BOHM, HJ ;
AHLRICHS, R .
JOURNAL OF CHEMICAL PHYSICS, 1982, 77 (04) :2028-2034
[4]   MOLECULAR-DYNAMICS SIMULATION OF LIQUID CH3F, CHF3, CH3CL, CH3CN, CO2 AND CS2 WITH NEW PAIR POTENTIALS [J].
BOHM, HJ ;
MEISSNER, C ;
AHLRICHS, R .
MOLECULAR PHYSICS, 1984, 53 (03) :651-672
[5]   MOLECULAR-DYNAMICS SIMULATION OF LIQUID CH2CL2 AND CHCL3 WITH NEW PAIR POTENTIALS [J].
BOHM, HJ ;
AHLRICHS, R .
MOLECULAR PHYSICS, 1985, 54 (06) :1261-1274
[6]   INTERMOLECULAR POTENTIALS FOR CH4, CH3F, CHF3, CH3CL, CH2CL2, CH3CN AND CO2 [J].
BOHM, HJ ;
AHLRICHS, R ;
SCHARF, P ;
SCHIFFER, H .
JOURNAL OF CHEMICAL PHYSICS, 1984, 81 (03) :1389-1395
[7]   MOLECULAR-DYNAMICS SIMULATION OF LIQUID CS2 - THE EFFECT OF HIGHER-ORDER CONTRIBUTIONS C-8, C-10 TO THE DISPERSION ENERGY [J].
BOHM, HJ ;
AHLRICHS, R .
MOLECULAR PHYSICS, 1985, 55 (02) :445-446
[8]  
BRUINING J, 1975, MOL PHYS, V31, P1425
[9]   PROPERTIES OF LIQUID-NITROGEN .4. COMPUTER-SIMULATION [J].
CHEUNG, PSY ;
POWLES, JG .
MOLECULAR PHYSICS, 1975, 30 (03) :921-949
[10]  
DYMOND JH, 1980, VIRAL COEFFICIENTS P