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ACS电子期刊(101)
在“
ACS电子期刊
”中,
命中:
101
条,耗时:0.0319859 秒
在所有数据库中总计命中:
1,735
条
1.
Correction to Semiex
p
erimental Equilibrium Structures for Building Blocks of Organic and Biological Molecules: The B2PLYP Route
作者:
Emanuele
P
enocchio
;
Matteo
P
iccardo
;
Vincenzo
Barone
刊名:Journal of Chemical Theory and Com
p
utation
出版年:2016
2.
Teaching Inorganic
P
hoto
p
hysics and Photochemistry with Three Ruthenium(II) Poly
p
yridyl Com
p
lexes: A Com
p
uter-Based Exercise
作者:
Claudio Garino
;
Alessio Terenzi
;
Giam
p
aolo
Barone
;
Luca Salassa
刊名:Journal of Chemical Education
出版年:2016
3.
Correction to Semi-Ex
p
erimental Equilibrium Structure Determinations by Em
p
loying B3LYP/SNSD Anharmonic Force Fields: Validation and A
pp
lication to Semirigid Organic Molecules
作者:
Matteo
P
iccardo
;
Emanuele
P
enocchio
;
Cristina
P
uzzarini
;
Malgorzata Biczysko
;
Vincenzo
Barone
刊名:Journal of
P
hysical Chemistry A
出版年:2016
4.
Toward a General Yet Effective Com
p
utational A
pp
roach for Diffusive Problems: Variable Diffusion Tensor and DVR Solution of the Smoluchowski Equation along a General One-Dimensional Coordinate
作者:
Andrea
P
iserchia
;
Vincenzo
Barone
刊名:Journal of Chemical Theory and Com
p
utation
出版年:2016
5.
Anharmonic Com
p
utations Meet Ex
p
eriments (IR, Raman, Neutron Diffraction) for Ex
p
laining the Behavior of 1,3,5-Tribromo-2,4,6-trimethylbenzene
作者:
Jean Meinnel
;
Camille Latouche
;
Soumia Ghanemi
;
Abdou Boucekkine
;
Vincenzo
Barone
;
Alain Moréac
;
Ali Boudjada
刊名:Journal of
P
hysical Chemistry A
出版年:2016
6.
Simulation of Vacuum UV Absor
p
tion and Electronic Circular Dichroism S
p
ectra of Methyl Oxirane: The Role of Vibrational Effects
作者:
Manuel Hodecker
;
Malgorzata Biczysko
;
Andreas Dreuw
;
Vincenzo
Barone
刊名:Journal of Chemical Theory and Com
p
utation
出版年:2016
7.
Anharmonicity Effects in IR S
p
ectra of [Re(X)(CO)3(伪-diimine)] (伪-diimine = 2,2鈥?bi
p
yridine or
p
yridylimidazo[1,5-a]
p
yridine; X = Cl or NCS) Com
p
lexes in Ground and Excited Electroni
作者:
Hana Kva
p
ilov谩
;
Anton铆n Vl膷ek
;
Jr.
;
Vincenzo
Barone
;
Malgorzata Biczysko
;
Stanislav Z谩li拧
刊名:Journal of
P
hysical Chemistry A
出版年:2015
8.
Accurate Infrared (IR) S
p
ectra for Molecules Containing the C鈮 Moiety by Anharmonic Com
p
utations with the Double Hybrid B2PLYP Density Functional
作者:
Fanny Vazart
;
Camille Latouche
;
P
aola Cimino
;
Vincenzo
Barone
刊名:Journal of Chemical Theory and Com
p
utation
出版年:2015
9.
Semiex
p
erimental Equilibrium Structures for Building Blocks of Organic and Biological Molecules: The B2PLYP Route
作者:
Emanuele
P
enocchio
;
Matteo
P
iccardo
;
Vincenzo
Barone
刊名:Journal of Chemical Theory and Com
p
utation
出版年:2015
10.
Mechanism of Immobilized
P
rotein A Binding to Immunoglobulin G on Nanosensor Array Surfaces
作者:
Justin T. Nelson
;
Sojin Kim
;
Nigel F. Reuel
;
Daniel
P
. Salem
;
Gili Bisker
;
Markita
P
. Landry
;
Sebastian Kruss
;
P
aul W.
Barone
;
Seonyeong Kwak
;
Michael S. Strano
刊名:Analytical Chemistry
出版年:2015
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