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density functional theory (võtmesõna)
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1
artikkel ajakirjas
Calculated tautomeric equilibria and X-ray structures of 2-substituted N-methoxy-9-methyl-9H-purin-6-amines
Gundersen, Lise-Lotte
;
Görbitz, Carl Henrik
;
Neier, Liina
;
Roggen, Heidi
;
Tamm, Toomas
Theoretical chemistry accounts
2011
/
p. 349-359
artikkel ajakirjas
2
artikkel ajakirjas
Investigation of the solar cell materials Cu(In,Ga)Se2 and Cu2ZnSnS4 with muon spin spectroscopy and density-functional calculations
Vilao, Rui C.
;
Marinopoulos, Apostolos G.
;
dos Santos, Diego Garcia
;
Alberto, Helena Vieira
;
Gil, Joao Campos
;
Mengyan, Patrick W.
;
Kauk-Kuusik, Marit
;
Lord, James
;
Weidinger, Alois
Journal of applied physics
2024
/
art. 055704
https://doi.org/10.1063/5.0205837
artikkel ajakirjas
3
artikkel ajakirjas
Isomers and conformers of complexes of Ti(OiPr)4 with cuclopentane-1,2-dione : NMR study and DFT calculations
Osadchuk, Irina
;
Pehk, Tõnis
;
Paju, Anne
;
Lopp, Margus
;
Öeren, Mario
;
Tamm, Toomas
International journal of quantum chemistry
2014
/
p. 1012-1018 : ill
artikkel ajakirjas
Kirjeid leitud 3, kuvan
1 - 3
võtmesõna
249
1.
density functional theory
2.
density functional theory (DFT)
3.
time-dependent density functional theory (TD-DFT)
4.
density functional calculations
5.
bimodal high-density polyethylene (HDPE) PE100
6.
complex density
7.
composite winding density control
8.
current density
9.
density
10.
density currents
11.
density dependence
12.
density distributions
13.
density forecasts
14.
density of representation
15.
Density-driven overfows
16.
direct density ratio estimation
17.
directional power spectral density
18.
dislocation density
19.
doping density
20.
electron density measurement
21.
field density in tissue
22.
high-density apolipoprotein A
23.
hyper-branched linear low density PE
24.
linear heat density
25.
Linear low-density polyethylene
26.
liquid density
27.
low density areas
28.
low density polyethylene (LDPE)
29.
low-density lipoprotein
30.
low-density lipoprotein (LDL) cholesterol
31.
low-density lipoprotein cholesterol
32.
low-density polyethylene
33.
low-density-polyethylene
34.
magnetic flux density
35.
material density
36.
medium density fibreboard (MDF) cracking
37.
oxidized low-density lipoproteins
38.
power density
39.
power spectral density
40.
probability density function
41.
projected device density of states (PDDOS)
42.
relative density
43.
species density
44.
wave density spectra
45.
vertical channel density (VD)
46.
vertical link density
47.
extra-functional verification
48.
FIM (functional independence measure)
49.
FIM + FAM (functional assessment measure)
50.
functional diversity
51.
functional approximation
52.
functional biomaterials
53.
functional BIST
54.
functional capacity of cooperation
55.
functional capacity of integration
56.
functional complexes
57.
functional components
58.
functional connectivity
59.
functional data analysis
60.
functional derating
61.
functional de-rating
62.
functional diversity
63.
functional equivalence principle
64.
Functional Failure Rate (FFR)
65.
functional fault model
66.
functional food
67.
functional gene analysis
68.
functional groups
69.
functional institutional analysis
70.
functional ionic liquids
71.
functional iteration
72.
functional material
73.
functional materials
74.
functional models
75.
functional morphology
76.
functional polymer
77.
functional power plants
78.
functional power-plants
79.
functional prediction
80.
functional properties
81.
functional reactive programming
82.
functional requirements
83.
functional safety
84.
functional self-test
85.
functional smoothie
86.
Functional specialist in AI for public services
87.
functional state of the muscles -tiredness
88.
functional stress programs
89.
functional test generation
90.
functional trait diversity
91.
functional verification
92.
functional-safety
93.
high-level functional fault model
94.
hybrid functional
95.
non-robust and functional sensitization
96.
non-robust and functional sensitization of delay faults
97.
size of functional groups
98.
a coherent theory of proofs
99.
activity theory
100.
adaptive structuration theory (AST)
101.
algebraic number theory
102.
algebraic theory
103.
algorithm design and theory
104.
beam theory
105.
bicategory theory
106.
catastrophe theory
107.
category theory
108.
chaos theory
109.
coding theory
110.
cognitive theory
111.
commitment theory
112.
communication channels (information theory)
113.
complexity leadership theory
114.
complexity theory
115.
computation theory
116.
computer softwaregraph theory
117.
conservation of resources theory
118.
Consumer Culture Theory
119.
control theory
120.
Cooper-Helmstetter cell cycle theory
121.
cosmology: theory
122.
critical theory of technology
123.
cultural theory of international relations
124.
dark matter theory
125.
decision theory
126.
Dempster-Shafer theory
127.
Demster-Shafer Theory
128.
dependent type theory
129.
design theory
130.
development theory
131.
Digital Government Theory: Development and Application
132.
dispersive theory
133.
domain theory
134.
ecological systems theory
135.
economic theory
136.
end of theory
137.
energetic impact theory
138.
enriched category theory
139.
evolutionary theory of policy capacity
140.
Flow theory
141.
formal category theory
142.
formal language theory
143.
fully nonlinear potential theory
144.
game theory
145.
general systems theory
146.
general theory of information transfer
147.
general vibration theory
148.
graph theory
149.
gravitational waves / theory
150.
grounded theory
151.
group theory
152.
group threat theory
153.
higher-order beam theory
154.
History and Theory
155.
homotopy theory
156.
homotopy type theory
157.
housemoney effect prospect theory
158.
iceberg theory of culture
159.
image theory
160.
information theory
161.
innovation theory
162.
institutional theory
163.
intellectual capital theory
164.
interdependence theory
165.
inverse problem theory/applications
166.
inverse problems theory/applications
167.
job search theory
168.
Lawvere theory
169.
layer-wise displacement theory
170.
linear systems theory
171.
maritime investment theory
172.
mechanism design theory
173.
middle-range theory
174.
modern portfolio theory
175.
network theory
176.
nonlinear shallow water theory
177.
nonlinear shallow-water theory
178.
nonlinear strip theory
179.
nonlinear theory
180.
normal torsion theory
181.
number theory
182.
organization theory
183.
organizational theory
184.
peer‐to‐peer theory
185.
perceived customer value theory
186.
phase field theory
187.
picture theory
188.
protection motivation theory
189.
proto-theory of design
190.
punctuated equilibrium theory
191.
rational choice theory
192.
real options theory
193.
realization theory
194.
reduction theory
195.
refined zigzag theory
196.
regulatory focus theory
197.
sampling theory
198.
scapegoat theory
199.
search and matching theory
200.
self-determination theory
201.
self-determination theory of work motivation
202.
set theory
203.
shallow water theory
204.
shallow‐water theory
205.
sign theory
206.
signalling theory
207.
social identity theory
208.
social practice theory
209.
social presence theory
210.
social representation theory
211.
social system theory
212.
social systems theory
213.
sociological curriculum theory
214.
S-O-R theory
215.
speech-act theory
216.
stakeholder theory
217.
Stakeholder-oriented decision theory
218.
State Theory
219.
stimulus-organism-response theory
220.
stochastic learning theory
221.
strategic narrative theory
222.
strategic narrative theory
223.
Straussian theory model
224.
structuration theory
225.
Sustainable Business Models Interdependence Theory’s Principle Of Interaction
226.
switching theory
227.
synchronous reference frame theory
228.
system theory
229.
systems theory
230.
the RAT theory
231.
theory
232.
theory and practice of meta-modelling with application in healthcare
233.
theory of accounting
234.
Theory of computation
235.
Theory Of Constraints (TOC)
236.
theory of economic development
237.
theory of inventive problem solving (TRIZ)
238.
theory of natural disaster
239.
Theory of paradox
240.
theory of planned behavior
241.
theory of planned behaviour
242.
theory of signs
243.
theory of value
244.
ticked cubical type theory
245.
type theory
246.
unified theory of acceptance and use of technology
247.
value theory
248.
virtual disc theory
249.
2D+T theory
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